N-(1,3-benzodioxol-5-ylmethyl)-2-cyclopropyl-3-(3-methoxyphenyl)-1-oxidanylidene-3,4-dihydroisoquinoline-4-carboxamide

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-2-cyclopropyl-3-(3-methoxyphenyl)-1-oxidanylidene-3,4-dihydroisoquinoline-4-carboxamide Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-2-cyclopropyl-3-(3-methoxyphenyl)-1-oxo-3,4-dihydroisoquinoline-4-carboxamide CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-2-cyclopropyl-3-(3-methoxyphenyl)-1-oxo-3,4-dihydroisoquinoline-4-carboxamide IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-2-cyclopropyl-3-(3-methoxyphenyl)-1-oxo-3,4-dihydroisoquinoline-4-carboxamide Traditional Name: 2-cyclopropyl-1-keto-3-(3-methoxyphenyl)-N-piperonyl-3,4-dihydroisoquinoline-4-carboxamide Formula: C28H26N2O5 MolecularWeight: 470.51644

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)C2C(C3=CC=CC=C3C(=O)N2C4CC4)C(=O)NCC5=CC6=C(C=C5)OCO6

Isomeric SMILES

COC1=CC=CC(=C1)C2C(C3=CC=CC=C3C(=O)N2C4CC4)C(=O)NCC5=CC6=C(C=C5)OCO6

InChI

InChI=1S/C28H26N2O5/c1-33-20-6-4-5-18(14-20)26-25(21-7-2-3-8-22(21)28(32)30(26)19-10-11-19)27(31)29-15-17-9-12-23-24(13-17)35-16-34-23/h2-9,12-14,19,25-26H,10-11,15-16H2,1H3,(H,29,31)