N-[2-[2-(3,5-ditert-butyl-4-oxidanyl-phenyl)ethyl]phenyl]-3,4-dihydro-1H-isoquinoline-2-carboxamide

Systemtic Name: N-[2-[2-(3,5-ditert-butyl-4-oxidanyl-phenyl)ethyl]phenyl]-3,4-dihydro-1H-isoquinoline-2-carboxamide Openeye Name: N-[2-[2-(3,5-ditert-butyl-4-hydroxy-phenyl)ethyl]phenyl]-3,4-dihydro-1H-isoquinoline-2-carboxamide CAS Name: N-[2-[2-(3,5-ditert-butyl-4-hydroxyphenyl)ethyl]phenyl]-3,4-dihydro-1H-isoquinoline-2-carboxamide IUPAC Name: N-[2-[2-(3,5-ditert-butyl-4-hydroxyphenyl)ethyl]phenyl]-3,4-dihydro-1H-isoquinoline-2-carboxamide Traditional Name: N-[2-[2-(3,5-ditert-butyl-4-hydroxy-phenyl)ethyl]phenyl]-3,4-dihydro-1H-isoquinoline-2-carboxamide Formula: C32H40N2O2 MolecularWeight: 484.6722

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=CC(=C1O)C(C)(C)C)CCC2=CC=CC=C2NC(=O)N3CCC4=CC=CC=C4C3

Isomeric SMILES

CC(C)(C)C1=CC(=CC(=C1O)C(C)(C)C)CCC2=CC=CC=C2NC(=O)N3CCC4=CC=CC=C4C3

InChI

InChI=1S/C32H40N2O2/c1-31(2,3)26-19-22(20-27(29(26)35)32(4,5)6)15-16-24-12-9-10-14-28(24)33-30(36)34-18-17-23-11-7-8-13-25(23)21-34/h7-14,19-20,35H,15-18,21H2,1-6H3,(H,33,36)