(1-methylpiperidin-1-ium-4-yl) (E)-3-(4-nitrophenyl)prop-2-enoate

Systemtic Name: (1-methylpiperidin-1-ium-4-yl) (E)-3-(4-nitrophenyl)prop-2-enoate Openeye Name: (1-methylpiperidin-1-ium-4-yl) (E)-3-(4-nitrophenyl)prop-2-enoate CAS Name: (E)-3-(4-nitrophenyl)-2-propenoic acid (1-methyl-4-piperidin-1-iumyl) ester IUPAC Name: (1-methylpiperidin-1-ium-4-yl) (E)-3-(4-nitrophenyl)prop-2-enoate Traditional Name: (E)-3-(4-nitrophenyl)acrylic acid (1-methylpiperidin-1-ium-4-yl) ester Formula: C15H19N2O4+ MolecularWeight: 291.32236

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCC(CC1)OC(=O)C=CC2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

C[NH+]1CCC(CC1)OC(=O)/C=C/C2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C15H18N2O4/c1-16-10-8-14(9-11-16)21-15(18)7-4-12-2-5-13(6-3-12)17(19)20/h2-7,14H,8-11H2,1H3/p+1/b7-4+