6-azanyl-7-(3-azanylpyrrolidin-1-yl)-1-cyclopropyl-4-oxidanylidene-quinoline-3-carboxylic acid

Systemtic Name: 6-azanyl-7-(3-azanylpyrrolidin-1-yl)-1-cyclopropyl-4-oxidanylidene-quinoline-3-carboxylic acid Openeye Name: 6-amino-7-(3-aminopyrrolidin-1-yl)-1-cyclopropyl-4-oxo-quinoline-3-carboxylic acid CAS Name: 6-amino-7-(3-amino-1-pyrrolidinyl)-1-cyclopropyl-4-oxo-3-quinolinecarboxylic acid IUPAC Name: 6-amino-7-(3-aminopyrrolidin-1-yl)-1-cyclopropyl-4-oxoquinoline-3-carboxylic acid Traditional Name: 6-amino-7-(3-aminopyrrolidino)-1-cyclopropyl-4-keto-quinoline-3-carboxylic acid Formula: C17H20N4O3 MolecularWeight: 328.3657

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC1N2C=C(C(=O)C3=CC(=C(C=C32)N4CCC(C4)N)N)C(=O)O

Isomeric SMILES

C1CC1N2C=C(C(=O)C3=CC(=C(C=C32)N4CCC(C4)N)N)C(=O)O

InChI

InChI=1S/C17H20N4O3/c18-9-3-4-20(7-9)15-6-14-11(5-13(15)19)16(22)12(17(23)24)8-21(14)10-1-2-10/h5-6,8-10H,1-4,7,18-19H2,(H,23,24)