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

Systemtic Name: 2-[2-[(3,4-dimethoxyphenyl)methyl]-3-nitro-phenyl]-N-methyl-ethanamine Openeye Name: 2-[2-[(3,4-dimethoxyphenyl)methyl]-3-nitro-phenyl]-N-methyl-ethanamine CAS Name: 2-[2-[(3,4-dimethoxyphenyl)methyl]-3-nitrophenyl]-N-methylethanamine IUPAC Name: 2-[2-[(3,4-dimethoxyphenyl)methyl]-3-nitrophenyl]-N-methylethanamine Traditional Name: methyl-[2-(3-nitro-2-veratryl-phenyl)ethyl]amine Formula: C18H22N2O4 MolecularWeight: 330.37828

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Descriptors Computed from Structure

Canonical SMILES:

CNCCC1=C(C(=CC=C1)[N+](=O)[O-])CC2=CC(=C(C=C2)OC)OC

Isomeric SMILES

CNCCC1=C(C(=CC=C1)[N+](=O)[O-])CC2=CC(=C(C=C2)OC)OC

InChI

InChI=1S/C18H22N2O4/c1-19-10-9-14-5-4-6-16(20(21)22)15(14)11-13-7-8-17(23-2)18(12-13)24-3/h4-8,12,19H,9-11H2,1-3H3