N-(1,3-benzodioxol-5-ylmethyl)-N-[(6,7-dimethyl-2-oxidanylidene-1H-quinolin-3-yl)methyl]cyclohexanecarboxamide

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-N-[(6,7-dimethyl-2-oxidanylidene-1H-quinolin-3-yl)methyl]cyclohexanecarboxamide Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-N-[(6,7-dimethyl-2-oxo-1H-quinolin-3-yl)methyl]cyclohexanecarboxamide CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-N-[(6,7-dimethyl-2-oxo-1H-quinolin-3-yl)methyl]cyclohexanecarboxamide IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-N-[(6,7-dimethyl-2-oxo-1H-quinolin-3-yl)methyl]cyclohexanecarboxamide Traditional Name: N-[(2-keto-6,7-dimethyl-1H-quinolin-3-yl)methyl]-N-piperonyl-cyclohexanecarboxamide Formula: C27H30N2O4 MolecularWeight: 446.5381

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C2C(=C1)C=C(C(=O)N2)CN(CC3=CC4=C(C=C3)OCO4)C(=O)C5CCCCC5)C

Isomeric SMILES

CC1=C(C=C2C(=C1)C=C(C(=O)N2)CN(CC3=CC4=C(C=C3)OCO4)C(=O)C5CCCCC5)C

InChI

InChI=1S/C27H30N2O4/c1-17-10-21-13-22(26(30)28-23(21)11-18(17)2)15-29(27(31)20-6-4-3-5-7-20)14-19-8-9-24-25(12-19)33-16-32-24/h8-13,20H,3-7,14-16H2,1-2H3,(H,28,30)