methyl (2R)-4-[(3S)-1,3-dimethyl-5-oxidanyl-2-oxidanylidene-indol-3-yl]-2-(methylamino)butanoate

Systemtic Name: methyl (2R)-4-[(3S)-1,3-dimethyl-5-oxidanyl-2-oxidanylidene-indol-3-yl]-2-(methylamino)butanoate Openeye Name: methyl (2R)-4-[(3S)-5-hydroxy-1,3-dimethyl-2-oxo-indolin-3-yl]-2-(methylamino)butanoate CAS Name: (2R)-4-[(3S)-5-hydroxy-1,3-dimethyl-2-oxo-3-indolyl]-2-(methylamino)butanoic acid methyl ester IUPAC Name: methyl (2R)-4-[(3S)-5-hydroxy-1,3-dimethyl-2-oxoindol-3-yl]-2-(methylamino)butanoate Traditional Name: (2R)-4-[(3S)-5-hydroxy-2-keto-1,3-dimethyl-indolin-3-yl]-2-(methylamino)butyric acid methyl ester Formula: C16H22N2O4 MolecularWeight: 306.35688

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C2=C(C=CC(=C2)O)N(C1=O)C)CCC(C(=O)OC)NC

Isomeric SMILES

C[C@@]1(C2=C(C=CC(=C2)O)N(C1=O)C)CC[C@H](C(=O)OC)NC

InChI

InChI=1S/C16H22N2O4/c1-16(8-7-12(17-2)14(20)22-4)11-9-10(19)5-6-13(11)18(3)15(16)21/h5-6,9,12,17,19H,7-8H2,1-4H3/t12-,16+/m1/s1