7-(4-azanyl-7-methyl-1,3,3a,4,7,7a-hexahydroisoindol-2-yl)-8-chloranyl-1-cyclopropyl-4-oxidanylidene-1,6-naphthyridine-3-carboxylate

Systemtic Name: 7-(4-azanyl-7-methyl-1,3,3a,4,7,7a-hexahydroisoindol-2-yl)-8-chloranyl-1-cyclopropyl-4-oxidanylidene-1,6-naphthyridine-3-carboxylate Openeye Name: 7-(4-amino-7-methyl-1,3,3a,4,7,7a-hexahydroisoindol-2-yl)-8-chloro-1-cyclopropyl-4-oxo-1,6-naphthyridine-3-carboxylate CAS Name: 7-(4-amino-7-methyl-1,3,3a,4,7,7a-hexahydroisoindol-2-yl)-8-chloro-1-cyclopropyl-4-oxo-1,6-naphthyridine-3-carboxylate IUPAC Name: 7-(4-amino-7-methyl-1,3,3a,4,7,7a-hexahydroisoindol-2-yl)-8-chloro-1-cyclopropyl-4-oxo-1,6-naphthyridine-3-carboxylate Traditional Name: 7-(4-amino-7-methyl-1,3,3a,4,7,7a-hexahydroisoindol-2-yl)-8-chloro-1-cyclopropyl-4-keto-1,6-naphthyridine-3-carboxylate Formula: C21H22ClN4O3- MolecularWeight: 413.87738

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1C=CC(C2C1CN(C2)C3=NC=C4C(=C3Cl)N(C=C(C4=O)C(=O)[O-])C5CC5)N

Isomeric SMILES

CC1C=CC(C2C1CN(C2)C3=NC=C4C(=C3Cl)N(C=C(C4=O)C(=O)[O-])C5CC5)N

InChI

InChI=1S/C21H23ClN4O3/c1-10-2-5-16(23)14-8-25(7-13(10)14)20-17(22)18-12(6-24-20)19(27)15(21(28)29)9-26(18)11-3-4-11/h2,5-6,9-11,13-14,16H,3-4,7-8,23H2,1H3,(H,28,29)/p-1