methyl (2R)-2-(2-methyl-4-phenyl-5,6-dihydrobenzo[h]quinolin-1-ium-1-yl)-2-phenyl-ethanoate

Systemtic Name: methyl (2R)-2-(2-methyl-4-phenyl-5,6-dihydrobenzo[h]quinolin-1-ium-1-yl)-2-phenyl-ethanoate Openeye Name: methyl (2R)-2-(2-methyl-4-phenyl-5,6-dihydrobenzo[h]quinolin-1-ium-1-yl)-2-phenyl-acetate CAS Name: (2R)-2-(2-methyl-4-phenyl-5,6-dihydrobenzo[h]quinolin-1-ium-1-yl)-2-phenylacetic acid methyl ester IUPAC Name: methyl (2R)-2-(2-methyl-4-phenyl-5,6-dihydrobenzo[h]quinolin-1-ium-1-yl)-2-phenylacetate Traditional Name: (2R)-2-(2-methyl-4-phenyl-5,6-dihydrobenzo[h]quinolin-1-ium-1-yl)-2-phenyl-acetic acid methyl ester Formula: C29H26NO2+ MolecularWeight: 420.52224

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Descriptors Computed from Structure

Canonical SMILES:

CC1=[N+](C2=C(CCC3=CC=CC=C32)C(=C1)C4=CC=CC=C4)C(C5=CC=CC=C5)C(=O)OC

Isomeric SMILES

CC1=[N+](C2=C(CCC3=CC=CC=C32)C(=C1)C4=CC=CC=C4)[C@H](C5=CC=CC=C5)C(=O)OC

InChI

InChI=1S/C29H26NO2/c1-20-19-26(21-11-5-3-6-12-21)25-18-17-22-13-9-10-16-24(22)28(25)30(20)27(29(31)32-2)23-14-7-4-8-15-23/h3-16,19,27H,17-18H2,1-2H3/q+1/t27-/m1/s1