dimethyl-[3-[[1-[(Z)-2-methyl-3-phenyl-prop-2-enyl]piperidin-1-ium-4-yl]carbonylamino]propyl]azanium

Systemtic Name: dimethyl-[3-[[1-[(Z)-2-methyl-3-phenyl-prop-2-enyl]piperidin-1-ium-4-yl]carbonylamino]propyl]azanium Openeye Name: dimethyl-[3-[[1-[(Z)-2-methyl-3-phenyl-allyl]piperidin-1-ium-4-carbonyl]amino]propyl]ammonium CAS Name: dimethyl-[3-[[[1-[(Z)-2-methyl-3-phenylprop-2-enyl]-4-piperidin-1-iumyl]-oxomethyl]amino]propyl]ammonium IUPAC Name: dimethyl-[3-[[1-[(Z)-2-methyl-3-phenylprop-2-enyl]piperidin-1-ium-4-carbonyl]amino]propyl]azanium Traditional Name: dimethyl-[3-[[1-[(Z)-2-methyl-3-phenyl-allyl]piperidin-1-ium-4-carbonyl]amino]propyl]ammonium Formula: C21H35N3O+2 MolecularWeight: 345.5221

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Descriptors Computed from Structure

Canonical SMILES:

CC(=CC1=CC=CC=C1)C[NH+]2CCC(CC2)C(=O)NCCC[NH+](C)C

Isomeric SMILES

C/C(=C/C1=CC=CC=C1)/C[NH+]2CCC(CC2)C(=O)NCCC[NH+](C)C

InChI

InChI=1S/C21H33N3O/c1-18(16-19-8-5-4-6-9-19)17-24-14-10-20(11-15-24)21(25)22-12-7-13-23(2)3/h4-6,8-9,16,20H,7,10-15,17H2,1-3H3,(H,22,25)/p+2/b18-16-