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

Systemtic Name: 3-[4-(1H-indol-3-yl)butanoylamino]benzoate Openeye Name: 3-[4-(1H-indol-3-yl)butanoylamino]benzoate CAS Name: 3-[[4-(1H-indol-3-yl)-1-oxobutyl]amino]benzoate IUPAC Name: 3-[4-(1H-indol-3-yl)butanoylamino]benzoate Traditional Name: 3-[4-(1H-indol-3-yl)butanoylamino]benzoate Formula: C19H17N2O3- MolecularWeight: 321.34988

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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