2-(4-tert-butylphenyl)sulfonyl-8a-[(4-morpholin-4-ylphenyl)methyl]-3,4,7,8-tetrahydro-1H-isoquinolin-6-one

Systemtic Name: 2-(4-tert-butylphenyl)sulfonyl-8a-[(4-morpholin-4-ylphenyl)methyl]-3,4,7,8-tetrahydro-1H-isoquinolin-6-one Openeye Name: 2-(4-tert-butylphenyl)sulfonyl-8a-[(4-morpholinophenyl)methyl]-3,4,7,8-tetrahydro-1H-isoquinolin-6-one CAS Name: 2-(4-tert-butylphenyl)sulfonyl-8a-[[4-(4-morpholinyl)phenyl]methyl]-3,4,7,8-tetrahydro-1H-isoquinolin-6-one IUPAC Name: 2-(4-tert-butylphenyl)sulfonyl-8a-[(4-morpholin-4-ylphenyl)methyl]-3,4,7,8-tetrahydro-1H-isoquinolin-6-one Traditional Name: 2-(4-tert-butylphenyl)sulfonyl-8a-(4-morpholinobenzyl)-3,4,7,8-tetrahydro-1H-isoquinolin-6-one Formula: C30H38N2O4S MolecularWeight: 522.69872

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)S(=O)(=O)N2CCC3=CC(=O)CCC3(C2)CC4=CC=C(C=C4)N5CCOCC5

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)S(=O)(=O)N2CCC3=CC(=O)CCC3(C2)CC4=CC=C(C=C4)N5CCOCC5

InChI

InChI=1S/C30H38N2O4S/c1-29(2,3)24-6-10-28(11-7-24)37(34,35)32-15-13-25-20-27(33)12-14-30(25,22-32)21-23-4-8-26(9-5-23)31-16-18-36-19-17-31/h4-11,20H,12-19,21-22H2,1-3H3