[1-[(Z)-2-methyl-3-phenyl-prop-2-enyl]piperidin-1-ium-4-yl]-piperidin-1-yl-methanone

Systemtic Name: [1-[(Z)-2-methyl-3-phenyl-prop-2-enyl]piperidin-1-ium-4-yl]-piperidin-1-yl-methanone Openeye Name: [1-[(Z)-2-methyl-3-phenyl-allyl]piperidin-1-ium-4-yl]-(1-piperidyl)methanone CAS Name: [1-[(Z)-2-methyl-3-phenylprop-2-enyl]-4-piperidin-1-iumyl]-(1-piperidinyl)methanone IUPAC Name: [1-[(Z)-2-methyl-3-phenylprop-2-enyl]piperidin-1-ium-4-yl]-piperidin-1-ylmethanone Traditional Name: [1-[(Z)-2-methyl-3-phenyl-allyl]piperidin-1-ium-4-yl]-piperidino-methanone Formula: C21H31N2O+ MolecularWeight: 327.48364

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Descriptors Computed from Structure

Canonical SMILES:

CC(=CC1=CC=CC=C1)C[NH+]2CCC(CC2)C(=O)N3CCCCC3

Isomeric SMILES

C/C(=C/C1=CC=CC=C1)/C[NH+]2CCC(CC2)C(=O)N3CCCCC3

InChI

InChI=1S/C21H30N2O/c1-18(16-19-8-4-2-5-9-19)17-22-14-10-20(11-15-22)21(24)23-12-6-3-7-13-23/h2,4-5,8-9,16,20H,3,6-7,10-15,17H2,1H3/p+1/b18-16-