N-[2-[(1-oxidanylcyclohexyl)methyl]-1-oxidanylidene-isoquinolin-5-yl]naphthalene-2-carboxamide

Systemtic Name: N-[2-[(1-oxidanylcyclohexyl)methyl]-1-oxidanylidene-isoquinolin-5-yl]naphthalene-2-carboxamide Openeye Name: N-[2-[(1-hydroxycyclohexyl)methyl]-1-oxo-5-isoquinolyl]naphthalene-2-carboxamide CAS Name: N-[2-[(1-hydroxycyclohexyl)methyl]-1-oxo-5-isoquinolinyl]-2-naphthalenecarboxamide IUPAC Name: N-[2-[(1-hydroxycyclohexyl)methyl]-1-oxoisoquinolin-5-yl]naphthalene-2-carboxamide Traditional Name: N-[2-[(1-hydroxycyclohexyl)methyl]-1-keto-5-isoquinolyl]-2-naphthamide Formula: C27H26N2O3 MolecularWeight: 426.50694

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)(CN2C=CC3=C(C2=O)C=CC=C3NC(=O)C4=CC5=CC=CC=C5C=C4)O

Isomeric SMILES

C1CCC(CC1)(CN2C=CC3=C(C2=O)C=CC=C3NC(=O)C4=CC5=CC=CC=C5C=C4)O

InChI

InChI=1S/C27H26N2O3/c30-25(21-12-11-19-7-2-3-8-20(19)17-21)28-24-10-6-9-23-22(24)13-16-29(26(23)31)18-27(32)14-4-1-5-15-27/h2-3,6-13,16-17,32H,1,4-5,14-15,18H2,(H,28,30)