4-[(E)-3-[4-(2-methoxyphenyl)piperazin-1-ium-1-yl]prop-1-enyl]-N,N-dimethyl-aniline

Systemtic Name: 4-[(E)-3-[4-(2-methoxyphenyl)piperazin-1-ium-1-yl]prop-1-enyl]-N,N-dimethyl-aniline Openeye Name: 4-[(E)-3-[4-(2-methoxyphenyl)piperazin-1-ium-1-yl]prop-1-enyl]-N,N-dimethyl-aniline CAS Name: 4-[(E)-3-[4-(2-methoxyphenyl)-1-piperazin-1-iumyl]prop-1-enyl]-N,N-dimethylaniline IUPAC Name: 4-[(E)-3-[4-(2-methoxyphenyl)piperazin-1-ium-1-yl]prop-1-enyl]-N,N-dimethylaniline Traditional Name: [4-[(E)-3-[4-(2-methoxyphenyl)piperazin-1-ium-1-yl]prop-1-enyl]phenyl]-dimethyl-amine Formula: C22H30N3O+ MolecularWeight: 352.4931

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=CC=C(C=C1)C=CC[NH+]2CCN(CC2)C3=CC=CC=C3OC

Isomeric SMILES

CN(C)C1=CC=C(C=C1)/C=C/C[NH+]2CCN(CC2)C3=CC=CC=C3OC

InChI

InChI=1S/C22H29N3O/c1-23(2)20-12-10-19(11-13-20)7-6-14-24-15-17-25(18-16-24)21-8-4-5-9-22(21)26-3/h4-13H,14-18H2,1-3H3/p+1/b7-6+