(2-chloranyl-4-nitro-phenyl)methyl 4-oxidanylidene-4-(quinolin-8-ylamino)butanoate

Systemtic Name: (2-chloranyl-4-nitro-phenyl)methyl 4-oxidanylidene-4-(quinolin-8-ylamino)butanoate Openeye Name: (2-chloro-4-nitro-phenyl)methyl 4-oxo-4-(8-quinolylamino)butanoate CAS Name: 4-oxo-4-(8-quinolinylamino)butanoic acid (2-chloro-4-nitrophenyl)methyl ester IUPAC Name: (2-chloro-4-nitrophenyl)methyl 4-oxo-4-(quinolin-8-ylamino)butanoate Traditional Name: 4-keto-4-(8-quinolylamino)butyric acid (2-chloro-4-nitro-benzyl) ester Formula: C20H16ClN3O5 MolecularWeight: 413.81114

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C(=C1)NC(=O)CCC(=O)OCC3=C(C=C(C=C3)[N+](=O)[O-])Cl)N=CC=C2

Isomeric SMILES

C1=CC2=C(C(=C1)NC(=O)CCC(=O)OCC3=C(C=C(C=C3)[N+](=O)[O-])Cl)N=CC=C2

InChI

InChI=1S/C20H16ClN3O5/c21-16-11-15(24(27)28)7-6-14(16)12-29-19(26)9-8-18(25)23-17-5-1-3-13-4-2-10-22-20(13)17/h1-7,10-11H,8-9,12H2,(H,23,25)