N-[1-[2-(7-cyano-3,4-dihydro-1H-isoquinolin-2-yl)ethyl]cyclohexyl]benzamide

Systemtic Name: N-[1-[2-(7-cyano-3,4-dihydro-1H-isoquinolin-2-yl)ethyl]cyclohexyl]benzamide Openeye Name: N-[1-[2-(7-cyano-3,4-dihydro-1H-isoquinolin-2-yl)ethyl]cyclohexyl]benzamide CAS Name: N-[1-[2-(7-cyano-3,4-dihydro-1H-isoquinolin-2-yl)ethyl]cyclohexyl]benzamide IUPAC Name: N-[1-[2-(7-cyano-3,4-dihydro-1H-isoquinolin-2-yl)ethyl]cyclohexyl]benzamide Traditional Name: N-[1-[2-(7-cyano-3,4-dihydro-1H-isoquinolin-2-yl)ethyl]cyclohexyl]benzamide Formula: C25H29N3O MolecularWeight: 387.51726

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)(CCN2CCC3=C(C2)C=C(C=C3)C#N)NC(=O)C4=CC=CC=C4

Isomeric SMILES

C1CCC(CC1)(CCN2CCC3=C(C2)C=C(C=C3)C#N)NC(=O)C4=CC=CC=C4

InChI

InChI=1S/C25H29N3O/c26-18-20-9-10-21-11-15-28(19-23(21)17-20)16-14-25(12-5-2-6-13-25)27-24(29)22-7-3-1-4-8-22/h1,3-4,7-10,17H,2,5-6,11-16,19H2,(H,27,29)