2-[2-[(E)-2-(10b,10c-dihydropyren-4-yl)ethenyl]-6-methoxy-quinolin-1-ium-1-yl]ethanamine

Systemtic Name: 2-[2-[(E)-2-(10b,10c-dihydropyren-4-yl)ethenyl]-6-methoxy-quinolin-1-ium-1-yl]ethanamine Openeye Name: 2-[2-[(E)-2-(10b,10c-dihydropyren-4-yl)vinyl]-6-methoxy-quinolin-1-ium-1-yl]ethanamine CAS Name: 2-[2-[(E)-2-(10b,10c-dihydropyren-4-yl)ethenyl]-6-methoxy-1-quinolin-1-iumyl]ethanamine IUPAC Name: 2-[2-[(E)-2-(10b,10c-dihydropyren-4-yl)ethenyl]-6-methoxyquinolin-1-ium-1-yl]ethanamine Traditional Name: 2-[2-[(E)-2-(10b,10c-dihydropyren-4-yl)vinyl]-6-methoxy-quinolin-1-ium-1-yl]ethylamine Formula: C30H27N2O+ MolecularWeight: 431.54818

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)[N+](=C(C=C2)C=CC3=CC4=CC=CC5=CC=C6C=CC=C3C6C54)CCN

Isomeric SMILES

COC1=CC2=C(C=C1)[N+](=C(C=C2)/C=C/C3=CC4=CC=CC5=CC=C6C=CC=C3C6C54)CCN

InChI

InChI=1S/C30H27N2O/c1-33-26-14-15-28-23(19-26)11-13-25(32(28)17-16-31)12-10-22-18-24-6-2-4-20-8-9-21-5-3-7-27(22)30(21)29(20)24/h2-15,18-19,29-30H,16-17,31H2,1H3/q+1/b12-10+