2-[[1-(carboxymethyl)-3-methyl-2-oxidanylidene-indol-3-yl]amino]-4-phenyl-butanoic acid

Systemtic Name: 2-[[1-(carboxymethyl)-3-methyl-2-oxidanylidene-indol-3-yl]amino]-4-phenyl-butanoic acid Openeye Name: 2-[[1-(carboxymethyl)-3-methyl-2-oxo-indolin-3-yl]amino]-4-phenyl-butanoic acid CAS Name: 2-[[1-(carboxymethyl)-3-methyl-2-oxo-3-indolyl]amino]-4-phenylbutanoic acid IUPAC Name: 2-[[1-(carboxymethyl)-3-methyl-2-oxoindol-3-yl]amino]-4-phenylbutanoic acid Traditional Name: 2-[[1-(carboxymethyl)-2-keto-3-methyl-indolin-3-yl]amino]-4-phenyl-butyric acid Formula: C21H22N2O5 MolecularWeight: 382.40978

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C2=CC=CC=C2N(C1=O)CC(=O)O)NC(CCC3=CC=CC=C3)C(=O)O

Isomeric SMILES

CC1(C2=CC=CC=C2N(C1=O)CC(=O)O)NC(CCC3=CC=CC=C3)C(=O)O

InChI

InChI=1S/C21H22N2O5/c1-21(22-16(19(26)27)12-11-14-7-3-2-4-8-14)15-9-5-6-10-17(15)23(20(21)28)13-18(24)25/h2-10,16,22H,11-13H2,1H3,(H,24,25)(H,26,27)