3-nitro-N-[(3-propoxyphenyl)methyl]aniline

Systemtic Name: 3-nitro-N-[(3-propoxyphenyl)methyl]aniline Openeye Name: 3-nitro-N-[(3-propoxyphenyl)methyl]aniline CAS Name: 3-nitro-N-[(3-propoxyphenyl)methyl]aniline IUPAC Name: 3-nitro-N-[(3-propoxyphenyl)methyl]aniline Traditional Name: (3-nitrophenyl)-(3-propoxybenzyl)amine Formula: C16H18N2O3 MolecularWeight: 286.32572

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC=CC(=C1)CNC2=CC(=CC=C2)[N+](=O)[O-]

Isomeric SMILES

CCCOC1=CC=CC(=C1)CNC2=CC(=CC=C2)[N+](=O)[O-]

InChI

InChI=1S/C16H18N2O3/c1-2-9-21-16-8-3-5-13(10-16)12-17-14-6-4-7-15(11-14)18(19)20/h3-8,10-11,17H,2,9,12H2,1H3