(3-phenylpyrrolidin-1-yl)-(1-piperidin-1-ylisoquinolin-4-yl)methanone

Systemtic Name: (3-phenylpyrrolidin-1-yl)-(1-piperidin-1-ylisoquinolin-4-yl)methanone Openeye Name: (3-phenylpyrrolidin-1-yl)-[1-(1-piperidyl)-4-isoquinolyl]methanone CAS Name: (3-phenyl-1-pyrrolidinyl)-[1-(1-piperidinyl)-4-isoquinolinyl]methanone IUPAC Name: (3-phenylpyrrolidin-1-yl)-(1-piperidin-1-ylisoquinolin-4-yl)methanone Traditional Name: (3-phenylpyrrolidino)-(1-piperidino-4-isoquinolyl)methanone Formula: C25H27N3O MolecularWeight: 385.50138

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C2=NC=C(C3=CC=CC=C32)C(=O)N4CCC(C4)C5=CC=CC=C5

Isomeric SMILES

C1CCN(CC1)C2=NC=C(C3=CC=CC=C32)C(=O)N4CCC(C4)C5=CC=CC=C5

InChI

InChI=1S/C25H27N3O/c29-25(28-16-13-20(18-28)19-9-3-1-4-10-19)23-17-26-24(27-14-7-2-8-15-27)22-12-6-5-11-21(22)23/h1,3-6,9-12,17,20H,2,7-8,13-16,18H2