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

Systemtic Name: (E)-3-[4-[methyl(pentan-3-yl)amino]-3-nitro-phenyl]prop-2-enoic acid Openeye Name: (E)-3-[4-[1-ethylpropyl(methyl)amino]-3-nitro-phenyl]prop-2-enoic acid CAS Name: (E)-3-[4-[methyl(pentan-3-yl)amino]-3-nitrophenyl]-2-propenoic acid IUPAC Name: (E)-3-[4-[methyl(pentan-3-yl)amino]-3-nitrophenyl]prop-2-enoic acid Traditional Name: (E)-3-[4-[1-ethylpropyl(methyl)amino]-3-nitro-phenyl]acrylic acid Formula: C15H20N2O4 MolecularWeight: 292.3303

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H20N2O4/c1-4-12(5-2)16(3)13-8-6-11(7-9-15(18)19)10-14(13)17(20)21/h6-10,12H,4-5H2,1-3H3,(H,18,19)/b9-7+