methyl 3-[1,3-bis(oxidanylidene)-6-piperidin-1-yl-benzo[de]isoquinolin-2-yl]propanoate

Systemtic Name: methyl 3-[1,3-bis(oxidanylidene)-6-piperidin-1-yl-benzo[de]isoquinolin-2-yl]propanoate Openeye Name: methyl 3-[1,3-dioxo-6-(1-piperidyl)benzo[de]isoquinolin-2-yl]propanoate CAS Name: 3-[1,3-dioxo-6-(1-piperidinyl)-2-benzo[de]isoquinolinyl]propanoic acid methyl ester IUPAC Name: methyl 3-(1,3-dioxo-6-piperidin-1-ylbenzo[de]isoquinolin-2-yl)propanoate Traditional Name: 3-(1,3-diketo-6-piperidino-benzo[de]isoquinolin-2-yl)propionic acid methyl ester Formula: C21H22N2O4 MolecularWeight: 366.41038

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCN1C(=O)C2=C3C(=C(C=C2)N4CCCCC4)C=CC=C3C1=O

Isomeric SMILES

COC(=O)CCN1C(=O)C2=C3C(=C(C=C2)N4CCCCC4)C=CC=C3C1=O

InChI

InChI=1S/C21H22N2O4/c1-27-18(24)10-13-23-20(25)15-7-5-6-14-17(22-11-3-2-4-12-22)9-8-16(19(14)15)21(23)26/h5-9H,2-4,10-13H2,1H3