1-methyl-7-[(E)-2-(1-methylpyridin-1-ium-2-yl)ethenyl]-2,3,4,5-tetrahydro-1-benzazepine

Systemtic Name: 1-methyl-7-[(E)-2-(1-methylpyridin-1-ium-2-yl)ethenyl]-2,3,4,5-tetrahydro-1-benzazepine Openeye Name: 1-methyl-7-[(E)-2-(1-methylpyridin-1-ium-2-yl)vinyl]-2,3,4,5-tetrahydro-1-benzazepine CAS Name: 1-methyl-7-[(E)-2-(1-methyl-2-pyridin-1-iumyl)ethenyl]-2,3,4,5-tetrahydro-1-benzazepine IUPAC Name: 1-methyl-7-[(E)-2-(1-methylpyridin-1-ium-2-yl)ethenyl]-2,3,4,5-tetrahydro-1-benzazepine Traditional Name: 1-methyl-7-[(E)-2-(1-methylpyridin-1-ium-2-yl)vinyl]-2,3,4,5-tetrahydro-1-benzazepine Formula: C19H23N2+ MolecularWeight: 279.39932

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCCCC2=C1C=CC(=C2)C=CC3=CC=CC=[N+]3C

Isomeric SMILES

CN1CCCCC2=C1C=CC(=C2)/C=C/C3=CC=CC=[N+]3C

InChI

InChI=1S/C19H23N2/c1-20-13-6-4-8-18(20)11-9-16-10-12-19-17(15-16)7-3-5-14-21(19)2/h4,6,8-13,15H,3,5,7,14H2,1-2H3/q+1