N-[(4-isoquinolin-5-ylphenyl)methyl]-3-methyl-3-phenyl-piperidine-1-carboxamide

Systemtic Name: N-[(4-isoquinolin-5-ylphenyl)methyl]-3-methyl-3-phenyl-piperidine-1-carboxamide Openeye Name: N-[[4-(5-isoquinolyl)phenyl]methyl]-3-methyl-3-phenyl-piperidine-1-carboxamide CAS Name: N-[[4-(5-isoquinolinyl)phenyl]methyl]-3-methyl-3-phenyl-1-piperidinecarboxamide IUPAC Name: N-[(4-isoquinolin-5-ylphenyl)methyl]-3-methyl-3-phenylpiperidine-1-carboxamide Traditional Name: N-[4-(5-isoquinolyl)benzyl]-3-methyl-3-phenyl-piperidine-1-carboxamide Formula: C29H29N3O MolecularWeight: 435.56006

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CCCN(C1)C(=O)NCC2=CC=C(C=C2)C3=CC=CC4=C3C=CN=C4)C5=CC=CC=C5

Isomeric SMILES

CC1(CCCN(C1)C(=O)NCC2=CC=C(C=C2)C3=CC=CC4=C3C=CN=C4)C5=CC=CC=C5

InChI

InChI=1S/C29H29N3O/c1-29(25-8-3-2-4-9-25)16-6-18-32(21-29)28(33)31-19-22-11-13-23(14-12-22)26-10-5-7-24-20-30-17-15-27(24)26/h2-5,7-15,17,20H,6,16,18-19,21H2,1H3,(H,31,33)