3-nitro-N-[(3,4,5-trimethoxyphenyl)methyl]aniline

Systemtic Name: 3-nitro-N-[(3,4,5-trimethoxyphenyl)methyl]aniline Openeye Name: 3-nitro-N-[(3,4,5-trimethoxyphenyl)methyl]aniline CAS Name: 3-nitro-N-[(3,4,5-trimethoxyphenyl)methyl]aniline IUPAC Name: 3-nitro-N-[(3,4,5-trimethoxyphenyl)methyl]aniline Traditional Name: (3-nitrophenyl)-(3,4,5-trimethoxybenzyl)amine Formula: C16H18N2O5 MolecularWeight: 318.32452

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)CNC2=CC(=CC=C2)[N+](=O)[O-]

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)CNC2=CC(=CC=C2)[N+](=O)[O-]

InChI

InChI=1S/C16H18N2O5/c1-21-14-7-11(8-15(22-2)16(14)23-3)10-17-12-5-4-6-13(9-12)18(19)20/h4-9,17H,10H2,1-3H3