(3S)-1-(2,4-dimethoxyphenyl)-N-[(2S)-octan-2-yl]-5-oxidanylidene-pyrrolidine-3-carboxamide

Systemtic Name: (3S)-1-(2,4-dimethoxyphenyl)-N-[(2S)-octan-2-yl]-5-oxidanylidene-pyrrolidine-3-carboxamide Openeye Name: (3S)-1-(2,4-dimethoxyphenyl)-N-[(1S)-1-methylheptyl]-5-oxo-pyrrolidine-3-carboxamide CAS Name: (3S)-1-(2,4-dimethoxyphenyl)-N-[(2S)-octan-2-yl]-5-oxo-3-pyrrolidinecarboxamide IUPAC Name: (3S)-1-(2,4-dimethoxyphenyl)-N-[(2S)-octan-2-yl]-5-oxopyrrolidine-3-carboxamide Traditional Name: (3S)-1-(2,4-dimethoxyphenyl)-5-keto-N-[(1S)-1-methylheptyl]pyrrolidine-3-carboxamide Formula: C21H32N2O4 MolecularWeight: 376.48978

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(C)NC(=O)C1CC(=O)N(C1)C2=C(C=C(C=C2)OC)OC

Isomeric SMILES

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

InChI

InChI=1S/C21H32N2O4/c1-5-6-7-8-9-15(2)22-21(25)16-12-20(24)23(14-16)18-11-10-17(26-3)13-19(18)27-4/h10-11,13,15-16H,5-9,12,14H2,1-4H3,(H,22,25)/t15-,16-/m0/s1