2-[7-[2-[bis(azanyl)methylideneamino]ethoxy]-1-ethyl-2-oxidanylidene-quinolin-3-yl]ethanoic acid

Systemtic Name: 2-[7-[2-[bis(azanyl)methylideneamino]ethoxy]-1-ethyl-2-oxidanylidene-quinolin-3-yl]ethanoic acid Openeye Name: 2-[1-ethyl-7-(2-guanidinoethoxy)-2-oxo-3-quinolyl]acetic acid CAS Name: 2-[7-[2-(diaminomethylideneamino)ethoxy]-1-ethyl-2-oxo-3-quinolinyl]acetic acid IUPAC Name: 2-[7-[2-(diaminomethylideneamino)ethoxy]-1-ethyl-2-oxoquinolin-3-yl]acetic acid Traditional Name: 2-[1-ethyl-7-(2-guanidinoethoxy)-2-keto-3-quinolyl]acetic acid Formula: C16H20N4O4 MolecularWeight: 332.3544

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C=CC(=C2)OCCN=C(N)N)C=C(C1=O)CC(=O)O

Isomeric SMILES

CCN1C2=C(C=CC(=C2)OCCN=C(N)N)C=C(C1=O)CC(=O)O

InChI

InChI=1S/C16H20N4O4/c1-2-20-13-9-12(24-6-5-19-16(17)18)4-3-10(13)7-11(15(20)23)8-14(21)22/h3-4,7,9H,2,5-6,8H2,1H3,(H,21,22)(H4,17,18,19)