4-[3-[(3-aminophenyl)methyl]indol-1-yl]-4-oxidanylidene-butanoic acid

Systemtic Name: 4-[3-[(3-aminophenyl)methyl]indol-1-yl]-4-oxidanylidene-butanoic acid Openeye Name: 4-[3-[(3-aminophenyl)methyl]indol-1-yl]-4-oxo-butanoic acid CAS Name: 4-[3-[(3-aminophenyl)methyl]-1-indolyl]-4-oxobutanoic acid IUPAC Name: 4-[3-[(3-aminophenyl)methyl]indol-1-yl]-4-oxobutanoic acid Traditional Name: 4-[3-(3-aminobenzyl)indol-1-yl]-4-keto-butyric acid Formula: C19H18N2O3 MolecularWeight: 322.35782

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=CN2C(=O)CCC(=O)O)CC3=CC(=CC=C3)N

Isomeric SMILES

C1=CC=C2C(=C1)C(=CN2C(=O)CCC(=O)O)CC3=CC(=CC=C3)N

InChI

InChI=1S/C19H18N2O3/c20-15-5-3-4-13(11-15)10-14-12-21(18(22)8-9-19(23)24)17-7-2-1-6-16(14)17/h1-7,11-12H,8-10,20H2,(H,23,24)