[6,7-dimethoxy-2,4-bis(oxidanylidene)-1H-quinolin-3-ylidene]-(2-piperidin-1-ium-1-ylethylamino)methanolate

Systemtic Name: [6,7-dimethoxy-2,4-bis(oxidanylidene)-1H-quinolin-3-ylidene]-(2-piperidin-1-ium-1-ylethylamino)methanolate Openeye Name: (6,7-dimethoxy-2,4-dioxo-1H-quinolin-3-ylidene)-(2-piperidin-1-ium-1-ylethylamino)methanolate CAS Name: (6,7-dimethoxy-2,4-dioxo-1H-quinolin-3-ylidene)-[2-(1-piperidin-1-iumyl)ethylamino]methanolate IUPAC Name: (6,7-dimethoxy-2,4-dioxo-1H-quinolin-3-ylidene)-(2-piperidin-1-ium-1-ylethylamino)methanolate Traditional Name: (2,4-diketo-6,7-dimethoxy-1H-quinolin-3-ylidene)-(2-piperidin-1-ium-1-ylethylamino)methanolate Formula: C19H25N3O5 MolecularWeight: 375.4189

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(=C1)C(=O)C(=C(NCC[NH+]3CCCCC3)[O-])C(=O)N2)OC

Isomeric SMILES

COC1=C(C=C2C(=C1)C(=O)C(=C(NCC[NH+]3CCCCC3)[O-])C(=O)N2)OC

InChI

InChI=1S/C19H25N3O5/c1-26-14-10-12-13(11-15(14)27-2)21-19(25)16(17(12)23)18(24)20-6-9-22-7-4-3-5-8-22/h10-11,20,24H,3-9H2,1-2H3,(H,21,25)