N-cyclohexyl-7-[2-(2-fluorophenyl)ethanoylamino]-3,4-dihydro-1H-isoquinoline-2-carboxamide

Systemtic Name: N-cyclohexyl-7-[2-(2-fluorophenyl)ethanoylamino]-3,4-dihydro-1H-isoquinoline-2-carboxamide Openeye Name: N-cyclohexyl-7-[[2-(2-fluorophenyl)acetyl]amino]-3,4-dihydro-1H-isoquinoline-2-carboxamide CAS Name: N-cyclohexyl-7-[[2-(2-fluorophenyl)-1-oxoethyl]amino]-3,4-dihydro-1H-isoquinoline-2-carboxamide IUPAC Name: N-cyclohexyl-7-[[2-(2-fluorophenyl)acetyl]amino]-3,4-dihydro-1H-isoquinoline-2-carboxamide Traditional Name: N-cyclohexyl-7-[[2-(2-fluorophenyl)acetyl]amino]-3,4-dihydro-1H-isoquinoline-2-carboxamide Formula: C24H28FN3O2 MolecularWeight: 409.496423

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)NC(=O)N2CCC3=C(C2)C=C(C=C3)NC(=O)CC4=CC=CC=C4F

Isomeric SMILES

C1CCC(CC1)NC(=O)N2CCC3=C(C2)C=C(C=C3)NC(=O)CC4=CC=CC=C4F

InChI

InChI=1S/C24H28FN3O2/c25-22-9-5-4-6-18(22)15-23(29)26-21-11-10-17-12-13-28(16-19(17)14-21)24(30)27-20-7-2-1-3-8-20/h4-6,9-11,14,20H,1-3,7-8,12-13,15-16H2,(H,26,29)(H,27,30)