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

Systemtic Name: N,N-dimethyl-4-[(E)-3-(4-phenylpiperazin-1-ium-1-yl)prop-1-enyl]aniline Openeye Name: N,N-dimethyl-4-[(E)-3-(4-phenylpiperazin-1-ium-1-yl)prop-1-enyl]aniline CAS Name: N,N-dimethyl-4-[(E)-3-(4-phenyl-1-piperazin-1-iumyl)prop-1-enyl]aniline IUPAC Name: N,N-dimethyl-4-[(E)-3-(4-phenylpiperazin-1-ium-1-yl)prop-1-enyl]aniline Traditional Name: dimethyl-[4-[(E)-3-(4-phenylpiperazin-1-ium-1-yl)prop-1-enyl]phenyl]amine Formula: C21H28N3+ MolecularWeight: 322.46712

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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=C3

Isomeric SMILES

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

InChI

InChI=1S/C21H27N3/c1-22(2)20-12-10-19(11-13-20)7-6-14-23-15-17-24(18-16-23)21-8-4-3-5-9-21/h3-13H,14-18H2,1-2H3/p+1/b7-6+