4-[5-[[3-(1,3-benzodioxol-5-yl)-9-oxidanylidene-3,4-dihydro-1H-pyrrolo[3,4-b]quinolin-2-yl]carbonyl]furan-2-yl]benzaldehyde

Systemtic Name: 4-[5-[[3-(1,3-benzodioxol-5-yl)-9-oxidanylidene-3,4-dihydro-1H-pyrrolo[3,4-b]quinolin-2-yl]carbonyl]furan-2-yl]benzaldehyde Openeye Name: 4-[5-[3-(1,3-benzodioxol-5-yl)-9-oxo-3,4-dihydro-1H-pyrrolo[3,4-b]quinoline-2-carbonyl]-2-furyl]benzaldehyde CAS Name: 4-[5-[[3-(1,3-benzodioxol-5-yl)-9-oxo-3,4-dihydro-1H-pyrrolo[3,4-b]quinolin-2-yl]-oxomethyl]-2-furanyl]benzaldehyde IUPAC Name: 4-[5-[3-(1,3-benzodioxol-5-yl)-9-oxo-3,4-dihydro-1H-pyrrolo[3,4-b]quinoline-2-carbonyl]furan-2-yl]benzaldehyde Traditional Name: 4-[5-[3-(1,3-benzodioxol-5-yl)-9-keto-3,4-dihydro-1H-pyrrolo[3,4-b]quinoline-2-carbonyl]-2-furyl]benzaldehyde Formula: C30H20N2O6 MolecularWeight: 504.4896

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Descriptors Computed from Structure

Canonical SMILES:

C1C2=C(C(N1C(=O)C3=CC=C(O3)C4=CC=C(C=C4)C=O)C5=CC6=C(C=C5)OCO6)NC7=CC=CC=C7C2=O

Isomeric SMILES

C1C2=C(C(N1C(=O)C3=CC=C(O3)C4=CC=C(C=C4)C=O)C5=CC6=C(C=C5)OCO6)NC7=CC=CC=C7C2=O

InChI

InChI=1S/C30H20N2O6/c33-15-17-5-7-18(8-6-17)23-11-12-25(38-23)30(35)32-14-21-27(31-22-4-2-1-3-20(22)29(21)34)28(32)19-9-10-24-26(13-19)37-16-36-24/h1-13,15,28H,14,16H2,(H,31,34)