N,1-dimethyl-N-[(E)-3-(2-nitrophenyl)prop-2-enyl]piperidin-1-ium-4-amine

Systemtic Name: N,1-dimethyl-N-[(E)-3-(2-nitrophenyl)prop-2-enyl]piperidin-1-ium-4-amine Openeye Name: N,1-dimethyl-N-[(E)-3-(2-nitrophenyl)allyl]piperidin-1-ium-4-amine CAS Name: N,1-dimethyl-N-[(E)-3-(2-nitrophenyl)prop-2-enyl]-4-piperidin-1-iumamine IUPAC Name: N,1-dimethyl-N-[(E)-3-(2-nitrophenyl)prop-2-enyl]piperidin-1-ium-4-amine Traditional Name: methyl-(1-methylpiperidin-1-ium-4-yl)-[(E)-3-(2-nitrophenyl)allyl]amine Formula: C16H24N3O2+ MolecularWeight: 290.38066

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H23N3O2/c1-17-12-9-15(10-13-17)18(2)11-5-7-14-6-3-4-8-16(14)19(20)21/h3-8,15H,9-13H2,1-2H3/p+1/b7-5+