6-azanyl-1-cyclopropyl-4-oxidanylidene-7-(3,3,5-trimethylpiperazin-1-yl)quinoline-3-carboxylic acid

Systemtic Name: 6-azanyl-1-cyclopropyl-4-oxidanylidene-7-(3,3,5-trimethylpiperazin-1-yl)quinoline-3-carboxylic acid Openeye Name: 6-amino-1-cyclopropyl-4-oxo-7-(3,3,5-trimethylpiperazin-1-yl)quinoline-3-carboxylic acid CAS Name: 6-amino-1-cyclopropyl-4-oxo-7-(3,3,5-trimethyl-1-piperazinyl)-3-quinolinecarboxylic acid IUPAC Name: 6-amino-1-cyclopropyl-4-oxo-7-(3,3,5-trimethylpiperazin-1-yl)quinoline-3-carboxylic acid Traditional Name: 6-amino-1-cyclopropyl-4-keto-7-(3,3,5-trimethylpiperazino)quinoline-3-carboxylic acid Formula: C20H26N4O3 MolecularWeight: 370.44544

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Descriptors Computed from Structure

Canonical SMILES:

CC1CN(CC(N1)(C)C)C2=C(C=C3C(=C2)N(C=C(C3=O)C(=O)O)C4CC4)N

Isomeric SMILES

CC1CN(CC(N1)(C)C)C2=C(C=C3C(=C2)N(C=C(C3=O)C(=O)O)C4CC4)N

InChI

InChI=1S/C20H26N4O3/c1-11-8-23(10-20(2,3)22-11)17-7-16-13(6-15(17)21)18(25)14(19(26)27)9-24(16)12-4-5-12/h6-7,9,11-12,22H,4-5,8,10,21H2,1-3H3,(H,26,27)