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

Systemtic Name: 1-(2-bromanylprop-2-enyl)-1,3-dimethyl-2-[(E)-2-thiophen-2-ylethenyl]benzo[e]indol-3-ium Openeye Name: 1-(2-bromoallyl)-1,3-dimethyl-2-[(E)-2-(2-thienyl)vinyl]benzo[e]indol-3-ium CAS Name: 1-(2-bromoprop-2-enyl)-1,3-dimethyl-2-[(E)-2-thiophen-2-ylethenyl]benzo[e]indol-3-ium IUPAC Name: 1-(2-bromoprop-2-enyl)-1,3-dimethyl-2-[(E)-2-thiophen-2-ylethenyl]benzo[e]indol-3-ium Traditional Name: 1-(2-bromoallyl)-1,3-dimethyl-2-[(E)-2-(2-thienyl)vinyl]benz[e]indol-3-ium Formula: C23H21BrNS+ MolecularWeight: 423.38854

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H21BrNS/c1-16(24)15-23(2)21(13-11-18-8-6-14-26-18)25(3)20-12-10-17-7-4-5-9-19(17)22(20)23/h4-14H,1,15H2,2-3H3/q+1/b13-11+