3-nitro-5-oxidanylidene-2-(4-piperidin-1-ylpiperidin-1-yl)-[1,3]benzothiazolo[3,2-a]quinoline-6-carboxylic acid

Systemtic Name: 3-nitro-5-oxidanylidene-2-(4-piperidin-1-ylpiperidin-1-yl)-[1,3]benzothiazolo[3,2-a]quinoline-6-carboxylic acid Openeye Name: 3-nitro-5-oxo-2-[4-(1-piperidyl)-1-piperidyl]-[1,3]benzothiazolo[3,2-a]quinoline-6-carboxylic acid CAS Name: 3-nitro-5-oxo-2-[4-(1-piperidinyl)-1-piperidinyl]-[1,3]benzothiazolo[3,2-a]quinoline-6-carboxylic acid IUPAC Name: 3-nitro-5-oxo-2-(4-piperidin-1-ylpiperidin-1-yl)-[1,3]benzothiazolo[3,2-a]quinoline-6-carboxylic acid Traditional Name: 5-keto-3-nitro-2-(4-piperidinopiperidino)-[1,3]benzothiazolo[3,2-a]quinoline-6-carboxylic acid Formula: C26H26N4O5S MolecularWeight: 506.57344

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C2CCN(CC2)C3=C(C=C4C(=C3)N5C6=CC=CC=C6SC5=C(C4=O)C(=O)O)[N+](=O)[O-]

Isomeric SMILES

C1CCN(CC1)C2CCN(CC2)C3=C(C=C4C(=C3)N5C6=CC=CC=C6SC5=C(C4=O)C(=O)O)[N+](=O)[O-]

InChI

InChI=1S/C26H26N4O5S/c31-24-17-14-21(30(34)35)20(28-12-8-16(9-13-28)27-10-4-1-5-11-27)15-19(17)29-18-6-2-3-7-22(18)36-25(29)23(24)26(32)33/h2-3,6-7,14-16H,1,4-5,8-13H2,(H,32,33)