(2S)-2-[2-(3,4-dimethoxyphenyl)ethyl-methyl-amino]-N-(2-methoxy-5-nitro-phenyl)propanamide

Systemtic Name: (2S)-2-[2-(3,4-dimethoxyphenyl)ethyl-methyl-amino]-N-(2-methoxy-5-nitro-phenyl)propanamide Openeye Name: (2S)-2-[2-(3,4-dimethoxyphenyl)ethyl-methyl-amino]-N-(2-methoxy-5-nitro-phenyl)propanamide CAS Name: (2S)-2-[2-(3,4-dimethoxyphenyl)ethyl-methylamino]-N-(2-methoxy-5-nitrophenyl)propanamide IUPAC Name: (2S)-2-[2-(3,4-dimethoxyphenyl)ethyl-methylamino]-N-(2-methoxy-5-nitrophenyl)propanamide Traditional Name: (2S)-2-[homoveratryl(methyl)amino]-N-(2-methoxy-5-nitro-phenyl)propionamide Formula: C21H27N3O6 MolecularWeight: 417.45558

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=C(C=CC(=C1)[N+](=O)[O-])OC)N(C)CCC2=CC(=C(C=C2)OC)OC

Isomeric SMILES

C[C@@H](C(=O)NC1=C(C=CC(=C1)[N+](=O)[O-])OC)N(C)CCC2=CC(=C(C=C2)OC)OC

InChI

InChI=1S/C21H27N3O6/c1-14(21(25)22-17-13-16(24(26)27)7-9-18(17)28-3)23(2)11-10-15-6-8-19(29-4)20(12-15)30-5/h6-9,12-14H,10-11H2,1-5H3,(H,22,25)/t14-/m0/s1