methyl (E)-3-(4-methoxy-6-methyl-3-nitro-pyridin-2-yl)-2-(phenylmethyl)prop-2-enoate

Systemtic Name: methyl (E)-3-(4-methoxy-6-methyl-3-nitro-pyridin-2-yl)-2-(phenylmethyl)prop-2-enoate Openeye Name: methyl (E)-2-benzyl-3-(4-methoxy-6-methyl-3-nitro-2-pyridyl)prop-2-enoate CAS Name: (E)-3-(4-methoxy-6-methyl-3-nitro-2-pyridinyl)-2-(phenylmethyl)-2-propenoic acid methyl ester IUPAC Name: methyl (E)-2-benzyl-3-(4-methoxy-6-methyl-3-nitropyridin-2-yl)prop-2-enoate Traditional Name: (E)-2-benzyl-3-(4-methoxy-6-methyl-3-nitro-2-pyridyl)acrylic acid methyl ester Formula: C18H18N2O5 MolecularWeight: 342.34592

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=C(C(=C1)OC)[N+](=O)[O-])C=C(CC2=CC=CC=C2)C(=O)OC

Isomeric SMILES

CC1=NC(=C(C(=C1)OC)[N+](=O)[O-])/C=C(\CC2=CC=CC=C2)/C(=O)OC

InChI

InChI=1S/C18H18N2O5/c1-12-9-16(24-2)17(20(22)23)15(19-12)11-14(18(21)25-3)10-13-7-5-4-6-8-13/h4-9,11H,10H2,1-3H3/b14-11+