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

Systemtic Name: (E)-3-[4-[methyl(propan-2-yl)amino]-3-nitro-phenyl]prop-2-enoic acid Openeye Name: (E)-3-[4-[isopropyl(methyl)amino]-3-nitro-phenyl]prop-2-enoic acid CAS Name: (E)-3-[4-[methyl(propan-2-yl)amino]-3-nitrophenyl]-2-propenoic acid IUPAC Name: (E)-3-[4-[methyl(propan-2-yl)amino]-3-nitrophenyl]prop-2-enoic acid Traditional Name: (E)-3-[4-[isopropyl(methyl)amino]-3-nitro-phenyl]acrylic acid Formula: C13H16N2O4 MolecularWeight: 264.27714

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H16N2O4/c1-9(2)14(3)11-6-4-10(5-7-13(16)17)8-12(11)15(18)19/h4-9H,1-3H3,(H,16,17)/b7-5+