N-[[4-[(4-methylphenyl)methylcarbamoyl]cyclohexyl]methyl]-1,2,3,4-tetrahydroisoquinoline-3-carboxamide

Systemtic Name: N-[[4-[(4-methylphenyl)methylcarbamoyl]cyclohexyl]methyl]-1,2,3,4-tetrahydroisoquinoline-3-carboxamide Openeye Name: N-[[4-(p-tolylmethylcarbamoyl)cyclohexyl]methyl]-1,2,3,4-tetrahydroisoquinoline-3-carboxamide CAS Name: N-[[4-[[(4-methylphenyl)methylamino]-oxomethyl]cyclohexyl]methyl]-1,2,3,4-tetrahydroisoquinoline-3-carboxamide IUPAC Name: N-[[4-[(4-methylphenyl)methylcarbamoyl]cyclohexyl]methyl]-1,2,3,4-tetrahydroisoquinoline-3-carboxamide Traditional Name: N-[[4-[(4-methylbenzyl)carbamoyl]cyclohexyl]methyl]-1,2,3,4-tetrahydroisoquinoline-3-carboxamide Formula: C26H33N3O2 MolecularWeight: 419.55912

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CNC(=O)C2CCC(CC2)CNC(=O)C3CC4=CC=CC=C4CN3

Isomeric SMILES

CC1=CC=C(C=C1)CNC(=O)C2CCC(CC2)CNC(=O)C3CC4=CC=CC=C4CN3

InChI

InChI=1S/C26H33N3O2/c1-18-6-8-19(9-7-18)15-28-25(30)21-12-10-20(11-13-21)16-29-26(31)24-14-22-4-2-3-5-23(22)17-27-24/h2-9,20-21,24,27H,10-17H2,1H3,(H,28,30)(H,29,31)