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

Systemtic Name: 2-[(3S)-1-cyclohexylpyrrolidin-3-yl]-6-(4-pyrrolidin-1-ylcarbonylphenyl)-3,4-dihydroisoquinolin-1-one Openeye Name: 2-[(3S)-1-cyclohexylpyrrolidin-3-yl]-6-[4-(pyrrolidine-1-carbonyl)phenyl]-3,4-dihydroisoquinolin-1-one CAS Name: 2-[(3S)-1-cyclohexyl-3-pyrrolidinyl]-6-[4-[oxo(1-pyrrolidinyl)methyl]phenyl]-3,4-dihydroisoquinolin-1-one IUPAC Name: 2-[(3S)-1-cyclohexylpyrrolidin-3-yl]-6-[4-(pyrrolidine-1-carbonyl)phenyl]-3,4-dihydroisoquinolin-1-one Traditional Name: 2-[(3S)-1-cyclohexylpyrrolidin-3-yl]-6-[4-(pyrrolidine-1-carbonyl)phenyl]-3,4-dihydroisocarbostyril Formula: C30H37N3O2 MolecularWeight: 471.63368

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)N2CCC(C2)N3CCC4=C(C3=O)C=CC(=C4)C5=CC=C(C=C5)C(=O)N6CCCC6

Isomeric SMILES

C1CCC(CC1)N2CC[C@@H](C2)N3CCC4=C(C3=O)C=CC(=C4)C5=CC=C(C=C5)C(=O)N6CCCC6

InChI

InChI=1S/C30H37N3O2/c34-29(31-16-4-5-17-31)23-10-8-22(9-11-23)24-12-13-28-25(20-24)14-19-33(30(28)35)27-15-18-32(21-27)26-6-2-1-3-7-26/h8-13,20,26-27H,1-7,14-19,21H2/t27-/m0/s1