3-(1,3-benzodioxol-5-yl)-N-(3,5-dimethylphenyl)-1-oxidanylidene-2-propyl-3,4-dihydroisoquinoline-4-carboxamide

Systemtic Name: 3-(1,3-benzodioxol-5-yl)-N-(3,5-dimethylphenyl)-1-oxidanylidene-2-propyl-3,4-dihydroisoquinoline-4-carboxamide Openeye Name: 3-(1,3-benzodioxol-5-yl)-N-(3,5-dimethylphenyl)-1-oxo-2-propyl-3,4-dihydroisoquinoline-4-carboxamide CAS Name: 3-(1,3-benzodioxol-5-yl)-N-(3,5-dimethylphenyl)-1-oxo-2-propyl-3,4-dihydroisoquinoline-4-carboxamide IUPAC Name: 3-(1,3-benzodioxol-5-yl)-N-(3,5-dimethylphenyl)-1-oxo-2-propyl-3,4-dihydroisoquinoline-4-carboxamide Traditional Name: 3-(1,3-benzodioxol-5-yl)-N-(3,5-dimethylphenyl)-1-keto-2-propyl-3,4-dihydroisoquinoline-4-carboxamide Formula: C28H28N2O4 MolecularWeight: 456.53292

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(C(C2=CC=CC=C2C1=O)C(=O)NC3=CC(=CC(=C3)C)C)C4=CC5=C(C=C4)OCO5

Isomeric SMILES

CCCN1C(C(C2=CC=CC=C2C1=O)C(=O)NC3=CC(=CC(=C3)C)C)C4=CC5=C(C=C4)OCO5

InChI

InChI=1S/C28H28N2O4/c1-4-11-30-26(19-9-10-23-24(15-19)34-16-33-23)25(21-7-5-6-8-22(21)28(30)32)27(31)29-20-13-17(2)12-18(3)14-20/h5-10,12-15,25-26H,4,11,16H2,1-3H3,(H,29,31)