3-[(3-tert-butyl-4-oxidanylidene-1,2-dihydropyrazolo[4,3-c]quinolin-7-yl)amino]-3-oxidanylidene-propanoic acid

Systemtic Name: 3-[(3-tert-butyl-4-oxidanylidene-1,2-dihydropyrazolo[4,3-c]quinolin-7-yl)amino]-3-oxidanylidene-propanoic acid Openeye Name: 3-[(3-tert-butyl-4-oxo-1,2-dihydropyrazolo[4,3-c]quinolin-7-yl)amino]-3-oxo-propanoic acid CAS Name: 3-[(3-tert-butyl-4-oxo-1,2-dihydropyrazolo[4,3-c]quinolin-7-yl)amino]-3-oxopropanoic acid IUPAC Name: 3-[(3-tert-butyl-4-oxo-1,2-dihydropyrazolo[4,3-c]quinolin-7-yl)amino]-3-oxopropanoic acid Traditional Name: 3-[(3-tert-butyl-4-keto-1,2-dihydropyrazolo[4,3-c]quinolin-7-yl)amino]-3-keto-propionic acid Formula: C17H18N4O4 MolecularWeight: 342.34922

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=C2C(=C3C=CC(=CC3=NC2=O)NC(=O)CC(=O)O)NN1

Isomeric SMILES

CC(C)(C)C1=C2C(=C3C=CC(=CC3=NC2=O)NC(=O)CC(=O)O)NN1

InChI

InChI=1S/C17H18N4O4/c1-17(2,3)15-13-14(20-21-15)9-5-4-8(6-10(9)19-16(13)25)18-11(22)7-12(23)24/h4-6,20-21H,7H2,1-3H3,(H,18,22)(H,23,24)