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

Systemtic Name: N,N-dimethyl-4-[(E)-3-(4-pyridin-1-ium-2-ylpiperazin-1-ium-1-yl)prop-1-enyl]aniline Openeye Name: N,N-dimethyl-4-[(E)-3-(4-pyridin-1-ium-2-ylpiperazin-1-ium-1-yl)prop-1-enyl]aniline CAS Name: N,N-dimethyl-4-[(E)-3-[4-(2-pyridin-1-iumyl)-1-piperazin-1-iumyl]prop-1-enyl]aniline IUPAC Name: N,N-dimethyl-4-[(E)-3-(4-pyridin-1-ium-2-ylpiperazin-1-ium-1-yl)prop-1-enyl]aniline Traditional Name: dimethyl-[4-[(E)-3-(4-pyridin-1-ium-2-ylpiperazin-1-ium-1-yl)prop-1-enyl]phenyl]amine Formula: C20H28N4+2 MolecularWeight: 324.46312

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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=[NH+]3

Isomeric SMILES

CN(C)C1=CC=C(C=C1)/C=C/C[NH+]2CCN(CC2)C3=CC=CC=[NH+]3

InChI

InChI=1S/C20H26N4/c1-22(2)19-10-8-18(9-11-19)6-5-13-23-14-16-24(17-15-23)20-7-3-4-12-21-20/h3-12H,13-17H2,1-2H3/p+2/b6-5+