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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1CN(C)C(C)C(=O)NC2=C(C=CC(=C2)[N+](=O)[O-])OC)OC)OC

Isomeric SMILES

CC1=CC(=C(C=C1CN(C)[C@@H](C)C(=O)NC2=C(C=CC(=C2)[N+](=O)[O-])OC)OC)OC

InChI

InChI=1S/C21H27N3O6/c1-13-9-19(29-5)20(30-6)10-15(13)12-23(3)14(2)21(25)22-17-11-16(24(26)27)7-8-18(17)28-4/h7-11,14H,12H2,1-6H3,(H,22,25)/t14-/m0/s1