N-[(3,4-dimethoxyphenyl)methyl]-1-(3-nitrophenyl)methanamine

Systemtic Name: N-[(3,4-dimethoxyphenyl)methyl]-1-(3-nitrophenyl)methanamine Openeye Name: N-[(3,4-dimethoxyphenyl)methyl]-1-(3-nitrophenyl)methanamine CAS Name: N-[(3,4-dimethoxyphenyl)methyl]-1-(3-nitrophenyl)methanamine IUPAC Name: N-[(3,4-dimethoxyphenyl)methyl]-1-(3-nitrophenyl)methanamine Traditional Name: (3-nitrobenzyl)-veratryl-amine Formula: C16H18N2O4 MolecularWeight: 302.32512

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CNCC2=CC(=CC=C2)[N+](=O)[O-])OC

Isomeric SMILES

COC1=C(C=C(C=C1)CNCC2=CC(=CC=C2)[N+](=O)[O-])OC

InChI

InChI=1S/C16H18N2O4/c1-21-15-7-6-13(9-16(15)22-2)11-17-10-12-4-3-5-14(8-12)18(19)20/h3-9,17H,10-11H2,1-2H3