2-(1H-Indole-3-carboxamido)benzoic acid

CAS	171817-95-1
Structure
Synonyms	Benzoic acid, 2-[(1H-indol-3-ylcarbonyl)amino]-
IUPAC Name	2-(1H-indole-3-carbonylamino)benzoic acid
Molecular Weight	280.28
Molecular Formula	C16H12N2O3
Canonical SMILES	C1=CC=C2C(=C1)C(=CN2)C(=O)NC3=CC=CC=C3C(=O)O
InChI	InChI=1S/C16H12N2O3/c19-15(12-9-17-13-7-3-1-5-10(12)13)18-14-8-4-2-6-11(14)16(20)21/h1-9,17H,(H,18,19)(H,20,21)
InChI Key	DRWUBVFXVNQIND-UHFFFAOYSA-N
Boiling Point	456.4±25.0 °C
Melting Point	248 °C
Purity	98%
Density	1.450±0.06 g/ml
pKa	3.49±0.36
Appearance	Solid