3-(4-tert-butylphenyl)-2,7-dimethyl-3,4-dihydroisoquinolin-1-one

Systemtic Name: 3-(4-tert-butylphenyl)-2,7-dimethyl-3,4-dihydroisoquinolin-1-one Openeye Name: 3-(4-tert-butylphenyl)-2,7-dimethyl-3,4-dihydroisoquinolin-1-one CAS Name: 3-(4-tert-butylphenyl)-2,7-dimethyl-3,4-dihydroisoquinolin-1-one IUPAC Name: 3-(4-tert-butylphenyl)-2,7-dimethyl-3,4-dihydroisoquinolin-1-one Traditional Name: 3-(4-tert-butylphenyl)-2,7-dimethyl-3,4-dihydroisocarbostyril Formula: C21H25NO MolecularWeight: 307.4293

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(CC(N(C2=O)C)C3=CC=C(C=C3)C(C)(C)C)C=C1

Isomeric SMILES

CC1=CC2=C(CC(N(C2=O)C)C3=CC=C(C=C3)C(C)(C)C)C=C1

InChI

InChI=1S/C21H25NO/c1-14-6-7-16-13-19(22(5)20(23)18(16)12-14)15-8-10-17(11-9-15)21(2,3)4/h6-12,19H,13H2,1-5H3