(E)-3-[4-(2-methylpiperidin-1-yl)-3-nitro-phenyl]prop-2-enoic acid

Systemtic Name: (E)-3-[4-(2-methylpiperidin-1-yl)-3-nitro-phenyl]prop-2-enoic acid Openeye Name: (E)-3-[4-(2-methyl-1-piperidyl)-3-nitro-phenyl]prop-2-enoic acid CAS Name: (E)-3-[4-(2-methyl-1-piperidinyl)-3-nitrophenyl]-2-propenoic acid IUPAC Name: (E)-3-[4-(2-methylpiperidin-1-yl)-3-nitrophenyl]prop-2-enoic acid Traditional Name: (E)-3-[4-(2-methylpiperidino)-3-nitro-phenyl]acrylic acid Formula: C15H18N2O4 MolecularWeight: 290.31442

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCCN1C2=C(C=C(C=C2)C=CC(=O)O)[N+](=O)[O-]

Isomeric SMILES

CC1CCCCN1C2=C(C=C(C=C2)/C=C/C(=O)O)[N+](=O)[O-]

InChI

InChI=1S/C15H18N2O4/c1-11-4-2-3-9-16(11)13-7-5-12(6-8-15(18)19)10-14(13)17(20)21/h5-8,10-11H,2-4,9H2,1H3,(H,18,19)/b8-6+