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

Systemtic Name: 2-[(3S)-1-propan-2-ylpyrrolidin-3-yl]-6-(4-pyrrolidin-1-ylcarbonylphenyl)-3,4-dihydroisoquinolin-1-one Openeye Name: 2-[(3S)-1-isopropylpyrrolidin-3-yl]-6-[4-(pyrrolidine-1-carbonyl)phenyl]-3,4-dihydroisoquinolin-1-one CAS Name: 6-[4-[oxo(1-pyrrolidinyl)methyl]phenyl]-2-[(3S)-1-propan-2-yl-3-pyrrolidinyl]-3,4-dihydroisoquinolin-1-one IUPAC Name: 2-[(3S)-1-propan-2-ylpyrrolidin-3-yl]-6-[4-(pyrrolidine-1-carbonyl)phenyl]-3,4-dihydroisoquinolin-1-one Traditional Name: 2-[(3S)-1-isopropylpyrrolidin-3-yl]-6-[4-(pyrrolidine-1-carbonyl)phenyl]-3,4-dihydroisocarbostyril Formula: C27H33N3O2 MolecularWeight: 431.56982

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N1CCC(C1)N2CCC3=C(C2=O)C=CC(=C3)C4=CC=C(C=C4)C(=O)N5CCCC5

Isomeric SMILES

CC(C)N1CC[C@@H](C1)N2CCC3=C(C2=O)C=CC(=C3)C4=CC=C(C=C4)C(=O)N5CCCC5

InChI

InChI=1S/C27H33N3O2/c1-19(2)29-15-12-24(18-29)30-16-11-23-17-22(9-10-25(23)27(30)32)20-5-7-21(8-6-20)26(31)28-13-3-4-14-28/h5-10,17,19,24H,3-4,11-16,18H2,1-2H3/t24-/m0/s1