1-(furan-2-ylmethyl)-1,3-dimethyl-2-[(E)-2-thiophen-2-ylethenyl]benzo[e]indol-3-ium

Systemtic Name: 1-(furan-2-ylmethyl)-1,3-dimethyl-2-[(E)-2-thiophen-2-ylethenyl]benzo[e]indol-3-ium Openeye Name: 1-(2-furylmethyl)-1,3-dimethyl-2-[(E)-2-(2-thienyl)vinyl]benzo[e]indol-3-ium CAS Name: 1-(2-furanylmethyl)-1,3-dimethyl-2-[(E)-2-thiophen-2-ylethenyl]benzo[e]indol-3-ium IUPAC Name: 1-(furan-2-ylmethyl)-1,3-dimethyl-2-[(E)-2-thiophen-2-ylethenyl]benzo[e]indol-3-ium Traditional Name: 1-(2-furfuryl)-1,3-dimethyl-2-[(E)-2-(2-thienyl)vinyl]benz[e]indol-3-ium Formula: C25H22NOS+ MolecularWeight: 384.51328

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C(=[N+](C2=C1C3=CC=CC=C3C=C2)C)C=CC4=CC=CS4)CC5=CC=CO5

Isomeric SMILES

CC1(C(=[N+](C2=C1C3=CC=CC=C3C=C2)C)/C=C/C4=CC=CS4)CC5=CC=CO5

InChI

InChI=1S/C25H22NOS/c1-25(17-19-8-5-15-27-19)23(14-12-20-9-6-16-28-20)26(2)22-13-11-18-7-3-4-10-21(18)24(22)25/h3-16H,17H2,1-2H3/q+1/b14-12+