2,2-dimethyl-3-oxidanylidene-3-[6-[(phenylmethyl)carbamoylamino]-2,3-dihydroindol-1-yl]propanoic acid

Systemtic Name: 2,2-dimethyl-3-oxidanylidene-3-[6-[(phenylmethyl)carbamoylamino]-2,3-dihydroindol-1-yl]propanoic acid Openeye Name: 3-[6-(benzylcarbamoylamino)indolin-1-yl]-2,2-dimethyl-3-oxo-propanoic acid CAS Name: 2,2-dimethyl-3-oxo-3-[6-[[oxo-[(phenylmethyl)amino]methyl]amino]-2,3-dihydroindol-1-yl]propanoic acid IUPAC Name: 3-[6-(benzylcarbamoylamino)-2,3-dihydroindol-1-yl]-2,2-dimethyl-3-oxopropanoic acid Traditional Name: 3-[6-(benzylcarbamoylamino)indolin-1-yl]-3-keto-2,2-dimethyl-propionic acid Formula: C21H23N3O4 MolecularWeight: 381.42502

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C(=O)N1CCC2=C1C=C(C=C2)NC(=O)NCC3=CC=CC=C3)C(=O)O

Isomeric SMILES

CC(C)(C(=O)N1CCC2=C1C=C(C=C2)NC(=O)NCC3=CC=CC=C3)C(=O)O

InChI

InChI=1S/C21H23N3O4/c1-21(2,19(26)27)18(25)24-11-10-15-8-9-16(12-17(15)24)23-20(28)22-13-14-6-4-3-5-7-14/h3-9,12H,10-11,13H2,1-2H3,(H,26,27)(H2,22,23,28)