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

Systemtic Name: 3-(1,3-benzodioxol-5-yl)-1-oxidanylidene-2-propyl-N-(pyridin-3-ylmethyl)-3,4-dihydroisoquinoline-4-carboxamide Openeye Name: 3-(1,3-benzodioxol-5-yl)-1-oxo-2-propyl-N-(3-pyridylmethyl)-3,4-dihydroisoquinoline-4-carboxamide CAS Name: 3-(1,3-benzodioxol-5-yl)-1-oxo-2-propyl-N-(3-pyridinylmethyl)-3,4-dihydroisoquinoline-4-carboxamide IUPAC Name: 3-(1,3-benzodioxol-5-yl)-1-oxo-2-propyl-N-(pyridin-3-ylmethyl)-3,4-dihydroisoquinoline-4-carboxamide Traditional Name: 3-(1,3-benzodioxol-5-yl)-1-keto-2-propyl-N-(3-pyridylmethyl)-3,4-dihydroisoquinoline-4-carboxamide Formula: C26H25N3O4 MolecularWeight: 443.4944

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(C(C2=CC=CC=C2C1=O)C(=O)NCC3=CN=CC=C3)C4=CC5=C(C=C4)OCO5

Isomeric SMILES

CCCN1C(C(C2=CC=CC=C2C1=O)C(=O)NCC3=CN=CC=C3)C4=CC5=C(C=C4)OCO5

InChI

InChI=1S/C26H25N3O4/c1-2-12-29-24(18-9-10-21-22(13-18)33-16-32-21)23(19-7-3-4-8-20(19)26(29)31)25(30)28-15-17-6-5-11-27-14-17/h3-11,13-14,23-24H,2,12,15-16H2,1H3,(H,28,30)