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

Systemtic Name: 3-(1,3-benzodioxol-5-yl)-1-oxidanylidene-2-propyl-N-prop-2-ynyl-3,4-dihydroisoquinoline-4-carboxamide Openeye Name: 3-(1,3-benzodioxol-5-yl)-1-oxo-2-propyl-N-prop-2-ynyl-3,4-dihydroisoquinoline-4-carboxamide CAS Name: 3-(1,3-benzodioxol-5-yl)-1-oxo-2-propyl-N-prop-2-ynyl-3,4-dihydroisoquinoline-4-carboxamide IUPAC Name: 3-(1,3-benzodioxol-5-yl)-1-oxo-2-propyl-N-prop-2-ynyl-3,4-dihydroisoquinoline-4-carboxamide Traditional Name: 3-(1,3-benzodioxol-5-yl)-1-keto-N-propargyl-2-propyl-3,4-dihydroisoquinoline-4-carboxamide Formula: C23H22N2O4 MolecularWeight: 390.43178

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(C(C2=CC=CC=C2C1=O)C(=O)NCC#C)C3=CC4=C(C=C3)OCO4

Isomeric SMILES

CCCN1C(C(C2=CC=CC=C2C1=O)C(=O)NCC#C)C3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C23H22N2O4/c1-3-11-24-22(26)20-16-7-5-6-8-17(16)23(27)25(12-4-2)21(20)15-9-10-18-19(13-15)29-14-28-18/h1,5-10,13,20-21H,4,11-12,14H2,2H3,(H,24,26)