1-[(2S)-pentan-2-yl]-2,4-diphenyl-5,6-dihydrobenzo[h]quinolin-1-ium

Systemtic Name: 1-[(2S)-pentan-2-yl]-2,4-diphenyl-5,6-dihydrobenzo[h]quinolin-1-ium Openeye Name: 1-[(1S)-1-methylbutyl]-2,4-diphenyl-5,6-dihydrobenzo[h]quinolin-1-ium CAS Name: 1-[(2S)-pentan-2-yl]-2,4-diphenyl-5,6-dihydrobenzo[h]quinolin-1-ium IUPAC Name: 1-[(2S)-pentan-2-yl]-2,4-diphenyl-5,6-dihydrobenzo[h]quinolin-1-ium Traditional Name: 1-[(1S)-1-methylbutyl]-2,4-diphenyl-5,6-dihydrobenzo[h]quinolin-1-ium Formula: C30H30N+ MolecularWeight: 404.5659

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C)[N+]1=C(C=C(C2=C1C3=CC=CC=C3CC2)C4=CC=CC=C4)C5=CC=CC=C5

Isomeric SMILES

CCC[C@H](C)[N+]1=C(C=C(C2=C1C3=CC=CC=C3CC2)C4=CC=CC=C4)C5=CC=CC=C5

InChI

InChI=1S/C30H30N/c1-3-12-22(2)31-29(25-16-8-5-9-17-25)21-28(23-13-6-4-7-14-23)27-20-19-24-15-10-11-18-26(24)30(27)31/h4-11,13-18,21-22H,3,12,19-20H2,1-2H3/q+1/t22-/m0/s1