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

Systemtic Name: 3-(1,3-benzodioxol-5-yl)-1-oxidanylidene-N-[3-(2-oxidanylidenepyrrolidin-1-yl)propyl]-2-propyl-3,4-dihydroisoquinoline-4-carboxamide Openeye Name: 3-(1,3-benzodioxol-5-yl)-1-oxo-N-[3-(2-oxopyrrolidin-1-yl)propyl]-2-propyl-3,4-dihydroisoquinoline-4-carboxamide CAS Name: 3-(1,3-benzodioxol-5-yl)-1-oxo-N-[3-(2-oxo-1-pyrrolidinyl)propyl]-2-propyl-3,4-dihydroisoquinoline-4-carboxamide IUPAC Name: 3-(1,3-benzodioxol-5-yl)-1-oxo-N-[3-(2-oxopyrrolidin-1-yl)propyl]-2-propyl-3,4-dihydroisoquinoline-4-carboxamide Traditional Name: 3-(1,3-benzodioxol-5-yl)-1-keto-N-[3-(2-ketopyrrolidino)propyl]-2-propyl-3,4-dihydroisoquinoline-4-carboxamide Formula: C27H31N3O5 MolecularWeight: 477.55214

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(C(C2=CC=CC=C2C1=O)C(=O)NCCCN3CCCC3=O)C4=CC5=C(C=C4)OCO5

Isomeric SMILES

CCCN1C(C(C2=CC=CC=C2C1=O)C(=O)NCCCN3CCCC3=O)C4=CC5=C(C=C4)OCO5

InChI

InChI=1S/C27H31N3O5/c1-2-13-30-25(18-10-11-21-22(16-18)35-17-34-21)24(19-7-3-4-8-20(19)27(30)33)26(32)28-12-6-15-29-14-5-9-23(29)31/h3-4,7-8,10-11,16,24-25H,2,5-6,9,12-15,17H2,1H3,(H,28,32)