6-[(1-methylpiperidin-4-yl)methyl]-4,7-bis(oxidanyl)-9-oxidanylidene-5H-phenazine-1-carboxylic acid

Systemtic Name: 6-[(1-methylpiperidin-4-yl)methyl]-4,7-bis(oxidanyl)-9-oxidanylidene-5H-phenazine-1-carboxylic acid Openeye Name: 4,7-dihydroxy-6-[(1-methyl-4-piperidyl)methyl]-9-oxo-5H-phenazine-1-carboxylic acid CAS Name: 4,7-dihydroxy-6-[(1-methyl-4-piperidinyl)methyl]-9-oxo-5H-phenazine-1-carboxylic acid IUPAC Name: 4,7-dihydroxy-6-[(1-methylpiperidin-4-yl)methyl]-9-oxo-5H-phenazine-1-carboxylic acid Traditional Name: 4,7-dihydroxy-9-keto-6-[(1-methyl-4-piperidyl)methyl]-5H-phenazine-1-carboxylic acid Formula: C20H21N3O5 MolecularWeight: 383.39784

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCC(CC1)CC2=C3C(=NC4=C(C=CC(=C4N3)O)C(=O)O)C(=O)C=C2O

Isomeric SMILES

CN1CCC(CC1)CC2=C3C(=NC4=C(C=CC(=C4N3)O)C(=O)O)C(=O)C=C2O

InChI

InChI=1S/C20H21N3O5/c1-23-6-4-10(5-7-23)8-12-14(25)9-15(26)19-17(12)22-18-13(24)3-2-11(20(27)28)16(18)21-19/h2-3,9-10,22,24-25H,4-8H2,1H3,(H,27,28)