N,N-diethyl-2-[4-[(E)-2-(1-methyl-2-phenyl-indol-3-yl)ethenyl]pyridin-1-ium-1-yl]ethanamine

Systemtic Name: N,N-diethyl-2-[4-[(E)-2-(1-methyl-2-phenyl-indol-3-yl)ethenyl]pyridin-1-ium-1-yl]ethanamine Openeye Name: N,N-diethyl-2-[4-[(E)-2-(1-methyl-2-phenyl-indol-3-yl)vinyl]pyridin-1-ium-1-yl]ethanamine CAS Name: N,N-diethyl-2-[4-[(E)-2-(1-methyl-2-phenyl-3-indolyl)ethenyl]-1-pyridin-1-iumyl]ethanamine IUPAC Name: N,N-diethyl-2-[4-[(E)-2-(1-methyl-2-phenylindol-3-yl)ethenyl]pyridin-1-ium-1-yl]ethanamine Traditional Name: diethyl-[2-[4-[(E)-2-(1-methyl-2-phenyl-indol-3-yl)vinyl]pyridin-1-ium-1-yl]ethyl]amine Formula: C28H32N3+ MolecularWeight: 410.57378

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CC[N+]1=CC=C(C=C1)C=CC2=C(N(C3=CC=CC=C32)C)C4=CC=CC=C4

Isomeric SMILES

CCN(CC)CC[N+]1=CC=C(C=C1)/C=C/C2=C(N(C3=CC=CC=C32)C)C4=CC=CC=C4

InChI

InChI=1S/C28H32N3/c1-4-30(5-2)21-22-31-19-17-23(18-20-31)15-16-26-25-13-9-10-14-27(25)29(3)28(26)24-11-7-6-8-12-24/h6-20H,4-5,21-22H2,1-3H3/q+1