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

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

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)CN2CCC(CC2)NC3=C(C=CC(=C3)[N+](=O)[O-])OC)OC

Isomeric SMILES

COC1=CC(=C(C=C1)CN2CCC(CC2)NC3=C(C=CC(=C3)[N+](=O)[O-])OC)OC

InChI

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