(E)-3-[2-[(3S)-3-methylpiperidin-1-yl]-5-nitro-phenyl]prop-2-enoate

Systemtic Name: (E)-3-[2-[(3S)-3-methylpiperidin-1-yl]-5-nitro-phenyl]prop-2-enoate Openeye Name: (E)-3-[2-[(3S)-3-methyl-1-piperidyl]-5-nitro-phenyl]prop-2-enoate CAS Name: (E)-3-[2-[(3S)-3-methyl-1-piperidinyl]-5-nitrophenyl]-2-propenoate IUPAC Name: (E)-3-[2-[(3S)-3-methylpiperidin-1-yl]-5-nitrophenyl]prop-2-enoate Traditional Name: (E)-3-[2-[(3S)-3-methylpiperidino]-5-nitro-phenyl]acrylate Formula: C15H17N2O4- MolecularWeight: 289.30648

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCN(C1)C2=C(C=C(C=C2)[N+](=O)[O-])C=CC(=O)[O-]

Isomeric SMILES

C[C@H]1CCCN(C1)C2=C(C=C(C=C2)[N+](=O)[O-])/C=C/C(=O)[O-]

InChI

InChI=1S/C15H18N2O4/c1-11-3-2-8-16(10-11)14-6-5-13(17(20)21)9-12(14)4-7-15(18)19/h4-7,9,11H,2-3,8,10H2,1H3,(H,18,19)/p-1/b7-4+/t11-/m0/s1