1-[(2,3-dimethoxyphenyl)methyl]-N-(2-methoxy-5-nitro-phenyl)piperidin-4-amine

Systemtic Name: 1-[(2,3-dimethoxyphenyl)methyl]-N-(2-methoxy-5-nitro-phenyl)piperidin-4-amine Openeye Name: 1-[(2,3-dimethoxyphenyl)methyl]-N-(2-methoxy-5-nitro-phenyl)piperidin-4-amine CAS Name: 1-[(2,3-dimethoxyphenyl)methyl]-N-(2-methoxy-5-nitrophenyl)-4-piperidinamine IUPAC Name: 1-[(2,3-dimethoxyphenyl)methyl]-N-(2-methoxy-5-nitrophenyl)piperidin-4-amine Traditional Name: (2-methoxy-5-nitro-phenyl)-(1-o-veratryl-4-piperidyl)amine Formula: C21H27N3O5 MolecularWeight: 401.45618

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)[N+](=O)[O-])NC2CCN(CC2)CC3=C(C(=CC=C3)OC)OC

Isomeric SMILES

COC1=C(C=C(C=C1)[N+](=O)[O-])NC2CCN(CC2)CC3=C(C(=CC=C3)OC)OC

InChI

InChI=1S/C21H27N3O5/c1-27-19-8-7-17(24(25)26)13-18(19)22-16-9-11-23(12-10-16)14-15-5-4-6-20(28-2)21(15)29-3/h4-8,13,16,22H,9-12,14H2,1-3H3