(E)-3-[4-[methyl(2-methylpropyl)amino]-3-nitro-phenyl]prop-2-enoic acid

Systemtic Name: (E)-3-[4-[methyl(2-methylpropyl)amino]-3-nitro-phenyl]prop-2-enoic acid Openeye Name: (E)-3-[4-[isobutyl(methyl)amino]-3-nitro-phenyl]prop-2-enoic acid CAS Name: (E)-3-[4-[methyl(2-methylpropyl)amino]-3-nitrophenyl]-2-propenoic acid IUPAC Name: (E)-3-[4-[methyl(2-methylpropyl)amino]-3-nitrophenyl]prop-2-enoic acid Traditional Name: (E)-3-[4-[isobutyl(methyl)amino]-3-nitro-phenyl]acrylic acid Formula: C14H18N2O4 MolecularWeight: 278.30372

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN(C)C1=C(C=C(C=C1)C=CC(=O)O)[N+](=O)[O-]

Isomeric SMILES

CC(C)CN(C)C1=C(C=C(C=C1)/C=C/C(=O)O)[N+](=O)[O-]

InChI

InChI=1S/C14H18N2O4/c1-10(2)9-15(3)12-6-4-11(5-7-14(17)18)8-13(12)16(19)20/h4-8,10H,9H2,1-3H3,(H,17,18)/b7-5+