3-(1,3-benzodioxol-5-yl)-N-[2-(1-methylpyrrolidin-2-yl)ethyl]-1-oxidanylidene-2-propyl-3,4-dihydroisoquinoline-4-carboxamide

Systemtic Name: 3-(1,3-benzodioxol-5-yl)-N-[2-(1-methylpyrrolidin-2-yl)ethyl]-1-oxidanylidene-2-propyl-3,4-dihydroisoquinoline-4-carboxamide Openeye Name: 3-(1,3-benzodioxol-5-yl)-N-[2-(1-methylpyrrolidin-2-yl)ethyl]-1-oxo-2-propyl-3,4-dihydroisoquinoline-4-carboxamide CAS Name: 3-(1,3-benzodioxol-5-yl)-N-[2-(1-methyl-2-pyrrolidinyl)ethyl]-1-oxo-2-propyl-3,4-dihydroisoquinoline-4-carboxamide IUPAC Name: 3-(1,3-benzodioxol-5-yl)-N-[2-(1-methylpyrrolidin-2-yl)ethyl]-1-oxo-2-propyl-3,4-dihydroisoquinoline-4-carboxamide Traditional Name: 3-(1,3-benzodioxol-5-yl)-1-keto-N-[2-(1-methylpyrrolidin-2-yl)ethyl]-2-propyl-3,4-dihydroisoquinoline-4-carboxamide Formula: C27H33N3O4 MolecularWeight: 463.56862

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(C(C2=CC=CC=C2C1=O)C(=O)NCCC3CCCN3C)C4=CC5=C(C=C4)OCO5

Isomeric SMILES

CCCN1C(C(C2=CC=CC=C2C1=O)C(=O)NCCC3CCCN3C)C4=CC5=C(C=C4)OCO5

InChI

InChI=1S/C27H33N3O4/c1-3-14-30-25(18-10-11-22-23(16-18)34-17-33-22)24(20-8-4-5-9-21(20)27(30)32)26(31)28-13-12-19-7-6-15-29(19)2/h4-5,8-11,16,19,24-25H,3,6-7,12-15,17H2,1-2H3,(H,28,31)