(E)-3-[2-[methyl(propan-2-yl)amino]-5-nitro-phenyl]prop-2-enoic acid

Systemtic Name: (E)-3-[2-[methyl(propan-2-yl)amino]-5-nitro-phenyl]prop-2-enoic acid Openeye Name: (E)-3-[2-[isopropyl(methyl)amino]-5-nitro-phenyl]prop-2-enoic acid CAS Name: (E)-3-[2-[methyl(propan-2-yl)amino]-5-nitrophenyl]-2-propenoic acid IUPAC Name: (E)-3-[2-[methyl(propan-2-yl)amino]-5-nitrophenyl]prop-2-enoic acid Traditional Name: (E)-3-[2-[isopropyl(methyl)amino]-5-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)[N+](=O)[O-])C=CC(=O)O

Isomeric SMILES

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

InChI

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