N-butan-2-yl-2-cyclohexyl-3-(4-methoxyphenyl)-1-oxidanylidene-3,4-dihydroisoquinoline-4-carboxamide

Systemtic Name: N-butan-2-yl-2-cyclohexyl-3-(4-methoxyphenyl)-1-oxidanylidene-3,4-dihydroisoquinoline-4-carboxamide Openeye Name: 2-cyclohexyl-3-(4-methoxyphenyl)-1-oxo-N-sec-butyl-3,4-dihydroisoquinoline-4-carboxamide CAS Name: N-butan-2-yl-2-cyclohexyl-3-(4-methoxyphenyl)-1-oxo-3,4-dihydroisoquinoline-4-carboxamide IUPAC Name: N-butan-2-yl-2-cyclohexyl-3-(4-methoxyphenyl)-1-oxo-3,4-dihydroisoquinoline-4-carboxamide Traditional Name: 2-cyclohexyl-1-keto-3-(4-methoxyphenyl)-N-sec-butyl-3,4-dihydroisoquinoline-4-carboxamide Formula: C27H34N2O3 MolecularWeight: 434.57046

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)NC(=O)C1C(N(C(=O)C2=CC=CC=C12)C3CCCCC3)C4=CC=C(C=C4)OC

Isomeric SMILES

CCC(C)NC(=O)C1C(N(C(=O)C2=CC=CC=C12)C3CCCCC3)C4=CC=C(C=C4)OC

InChI

InChI=1S/C27H34N2O3/c1-4-18(2)28-26(30)24-22-12-8-9-13-23(22)27(31)29(20-10-6-5-7-11-20)25(24)19-14-16-21(32-3)17-15-19/h8-9,12-18,20,24-25H,4-7,10-11H2,1-3H3,(H,28,30)