4-[4-(1H-indol-3-yl)butanoylamino]benzoic acid

Systemtic Name: 4-[4-(1H-indol-3-yl)butanoylamino]benzoic acid Openeye Name: 4-[4-(1H-indol-3-yl)butanoylamino]benzoic acid CAS Name: 4-[[4-(1H-indol-3-yl)-1-oxobutyl]amino]benzoic acid IUPAC Name: 4-[4-(1H-indol-3-yl)butanoylamino]benzoic acid Traditional Name: 4-[4-(1H-indol-3-yl)butanoylamino]benzoic acid Formula: C19H18N2O3 MolecularWeight: 322.35782

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=CN2)CCCC(=O)NC3=CC=C(C=C3)C(=O)O

Isomeric SMILES

C1=CC=C2C(=C1)C(=CN2)CCCC(=O)NC3=CC=C(C=C3)C(=O)O

InChI

InChI=1S/C19H18N2O3/c22-18(21-15-10-8-13(9-11-15)19(23)24)7-3-4-14-12-20-17-6-2-1-5-16(14)17/h1-2,5-6,8-12,20H,3-4,7H2,(H,21,22)(H,23,24)