3-[[(2-chlorophenyl)methyl-methyl-amino]methyl]-2,6,7-trimethyl-4-phenyl-isoquinolin-1-one

Systemtic Name: 3-[[(2-chlorophenyl)methyl-methyl-amino]methyl]-2,6,7-trimethyl-4-phenyl-isoquinolin-1-one Openeye Name: 3-[[(2-chlorophenyl)methyl-methyl-amino]methyl]-2,6,7-trimethyl-4-phenyl-isoquinolin-1-one CAS Name: 3-[[(2-chlorophenyl)methyl-methylamino]methyl]-2,6,7-trimethyl-4-phenyl-1-isoquinolinone IUPAC Name: 3-[[(2-chlorophenyl)methyl-methylamino]methyl]-2,6,7-trimethyl-4-phenylisoquinolin-1-one Traditional Name: 3-[[(2-chlorobenzyl)-methyl-amino]methyl]-2,6,7-trimethyl-4-phenyl-isocarbostyril Formula: C27H27ClN2O MolecularWeight: 430.96908

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C2C(=C1)C(=C(N(C2=O)C)CN(C)CC3=CC=CC=C3Cl)C4=CC=CC=C4)C

Isomeric SMILES

CC1=C(C=C2C(=C1)C(=C(N(C2=O)C)CN(C)CC3=CC=CC=C3Cl)C4=CC=CC=C4)C

InChI

InChI=1S/C27H27ClN2O/c1-18-14-22-23(15-19(18)2)27(31)30(4)25(26(22)20-10-6-5-7-11-20)17-29(3)16-21-12-8-9-13-24(21)28/h5-15H,16-17H2,1-4H3