2-[(3S)-1-cyclobutylpyrrolidin-3-yl]-6-(3-pyrrolidin-1-ylcarbonylphenyl)-3,4-dihydroisoquinolin-1-one

Systemtic Name: 2-[(3S)-1-cyclobutylpyrrolidin-3-yl]-6-(3-pyrrolidin-1-ylcarbonylphenyl)-3,4-dihydroisoquinolin-1-one Openeye Name: 2-[(3S)-1-cyclobutylpyrrolidin-3-yl]-6-[3-(pyrrolidine-1-carbonyl)phenyl]-3,4-dihydroisoquinolin-1-one CAS Name: 2-[(3S)-1-cyclobutyl-3-pyrrolidinyl]-6-[3-[oxo(1-pyrrolidinyl)methyl]phenyl]-3,4-dihydroisoquinolin-1-one IUPAC Name: 2-[(3S)-1-cyclobutylpyrrolidin-3-yl]-6-[3-(pyrrolidine-1-carbonyl)phenyl]-3,4-dihydroisoquinolin-1-one Traditional Name: 2-[(3S)-1-cyclobutylpyrrolidin-3-yl]-6-[3-(pyrrolidine-1-carbonyl)phenyl]-3,4-dihydroisocarbostyril Formula: C28H33N3O2 MolecularWeight: 443.58052

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C(=O)C2=CC=CC(=C2)C3=CC4=C(C=C3)C(=O)N(CC4)C5CCN(C5)C6CCC6

Isomeric SMILES

C1CCN(C1)C(=O)C2=CC=CC(=C2)C3=CC4=C(C=C3)C(=O)N(CC4)[C@H]5CCN(C5)C6CCC6

InChI

InChI=1S/C28H33N3O2/c32-27(29-13-1-2-14-29)23-6-3-5-20(18-23)21-9-10-26-22(17-21)11-16-31(28(26)33)25-12-15-30(19-25)24-7-4-8-24/h3,5-6,9-10,17-18,24-25H,1-2,4,7-8,11-16,19H2/t25-/m0/s1