2-(3,4-dimethoxyphenyl)-N-[(3-nitrophenyl)methyl]ethanamine

Systemtic Name: 2-(3,4-dimethoxyphenyl)-N-[(3-nitrophenyl)methyl]ethanamine Openeye Name: 2-(3,4-dimethoxyphenyl)-N-[(3-nitrophenyl)methyl]ethanamine CAS Name: 2-(3,4-dimethoxyphenyl)-N-[(3-nitrophenyl)methyl]ethanamine IUPAC Name: 2-(3,4-dimethoxyphenyl)-N-[(3-nitrophenyl)methyl]ethanamine Traditional Name: homoveratryl-(3-nitrobenzyl)amine Formula: C17H20N2O4 MolecularWeight: 316.3517

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CCNCC2=CC(=CC=C2)[N+](=O)[O-])OC

Isomeric SMILES

COC1=C(C=C(C=C1)CCNCC2=CC(=CC=C2)[N+](=O)[O-])OC

InChI

InChI=1S/C17H20N2O4/c1-22-16-7-6-13(11-17(16)23-2)8-9-18-12-14-4-3-5-15(10-14)19(20)21/h3-7,10-11,18H,8-9,12H2,1-2H3