methyl (E)-3-(4-methylphenyl)-2-[[(3-nitrophenyl)amino]methyl]prop-2-enoate

Systemtic Name: methyl (E)-3-(4-methylphenyl)-2-[[(3-nitrophenyl)amino]methyl]prop-2-enoate Openeye Name: methyl (E)-2-[(3-nitroanilino)methyl]-3-(p-tolyl)prop-2-enoate CAS Name: (E)-3-(4-methylphenyl)-2-[(3-nitroanilino)methyl]-2-propenoic acid methyl ester IUPAC Name: methyl (E)-3-(4-methylphenyl)-2-[(3-nitroanilino)methyl]prop-2-enoate Traditional Name: (E)-2-[(3-nitroanilino)methyl]-3-(p-tolyl)acrylic acid methyl ester Formula: C18H18N2O4 MolecularWeight: 326.34652

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C=C(CNC2=CC(=CC=C2)[N+](=O)[O-])C(=O)OC

Isomeric SMILES

CC1=CC=C(C=C1)/C=C(\CNC2=CC(=CC=C2)[N+](=O)[O-])/C(=O)OC

InChI

InChI=1S/C18H18N2O4/c1-13-6-8-14(9-7-13)10-15(18(21)24-2)12-19-16-4-3-5-17(11-16)20(22)23/h3-11,19H,12H2,1-2H3/b15-10+