(2S,3S)-2-[(2,3-dimethyl-1H-indol-5-yl)carbonylamino]-3-oxidanyl-butanoate

Systemtic Name: (2S,3S)-2-[(2,3-dimethyl-1H-indol-5-yl)carbonylamino]-3-oxidanyl-butanoate Openeye Name: (2S,3S)-2-[(2,3-dimethyl-1H-indole-5-carbonyl)amino]-3-hydroxy-butanoate CAS Name: (2S,3S)-2-[[(2,3-dimethyl-1H-indol-5-yl)-oxomethyl]amino]-3-hydroxybutanoate IUPAC Name: (2S,3S)-2-[(2,3-dimethyl-1H-indole-5-carbonyl)amino]-3-hydroxybutanoate Traditional Name: (2S,3S)-2-[(2,3-dimethyl-1H-indole-5-carbonyl)amino]-3-hydroxy-butyrate Formula: C15H17N2O4- MolecularWeight: 289.30648

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(NC2=C1C=C(C=C2)C(=O)NC(C(C)O)C(=O)[O-])C

Isomeric SMILES

CC1=C(NC2=C1C=C(C=C2)C(=O)N[C@@H]([C@H](C)O)C(=O)[O-])C

InChI

InChI=1S/C15H18N2O4/c1-7-8(2)16-12-5-4-10(6-11(7)12)14(19)17-13(9(3)18)15(20)21/h4-6,9,13,16,18H,1-3H3,(H,17,19)(H,20,21)/p-1/t9-,13-/m0/s1