N-(cyclopenta-1,4-dien-1-ylmethyl)-4-[4-(1-ethylpyridin-1-ium-4-yl)pyridin-1-ium-1-yl]aniline

Systemtic Name: N-(cyclopenta-1,4-dien-1-ylmethyl)-4-[4-(1-ethylpyridin-1-ium-4-yl)pyridin-1-ium-1-yl]aniline Openeye Name: N-(cyclopenta-1,4-dien-1-ylmethyl)-4-[4-(1-ethylpyridin-1-ium-4-yl)pyridin-1-ium-1-yl]aniline CAS Name: N-(1-cyclopenta-1,4-dienylmethyl)-4-[4-(1-ethyl-4-pyridin-1-iumyl)-1-pyridin-1-iumyl]aniline IUPAC Name: N-(cyclopenta-1,4-dien-1-ylmethyl)-4-[4-(1-ethylpyridin-1-ium-4-yl)pyridin-1-ium-1-yl]aniline Traditional Name: cyclopenta-1,4-dien-1-ylmethyl-[4-[4-(1-ethylpyridin-1-ium-4-yl)pyridin-1-ium-1-yl]phenyl]amine Formula: C24H25N3+2 MolecularWeight: 355.4754

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Descriptors Computed from Structure

Canonical SMILES:

CC[N+]1=CC=C(C=C1)C2=CC=[N+](C=C2)C3=CC=C(C=C3)NCC4=CCC=C4

Isomeric SMILES

CC[N+]1=CC=C(C=C1)C2=CC=[N+](C=C2)C3=CC=C(C=C3)NCC4=CCC=C4

InChI

InChI=1S/C24H24N3/c1-2-26-15-11-21(12-16-26)22-13-17-27(18-14-22)24-9-7-23(8-10-24)25-19-20-5-3-4-6-20/h3,5-18H,2,4,19H2,1H3/q+1/p+1