ethyl N-[[3-(2-chloranyl-6-nitro-phenyl)-4-phenyl-4,5-dihydro-1,2-oxazol-5-yl]methyl]carbamate

Systemtic Name: ethyl N-[[3-(2-chloranyl-6-nitro-phenyl)-4-phenyl-4,5-dihydro-1,2-oxazol-5-yl]methyl]carbamate Openeye Name: ethyl N-[[3-(2-chloro-6-nitro-phenyl)-4-phenyl-4,5-dihydroisoxazol-5-yl]methyl]carbamate CAS Name: N-[[3-(2-chloro-6-nitrophenyl)-4-phenyl-4,5-dihydroisoxazol-5-yl]methyl]carbamic acid ethyl ester IUPAC Name: ethyl N-[[3-(2-chloro-6-nitrophenyl)-4-phenyl-4,5-dihydro-1,2-oxazol-5-yl]methyl]carbamate Traditional Name: N-[[3-(2-chloro-6-nitro-phenyl)-4-phenyl-2-isoxazolin-5-yl]methyl]carbamic acid ethyl ester Formula: C19H18ClN3O5 MolecularWeight: 403.81632

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)NCC1C(C(=NO1)C2=C(C=CC=C2Cl)[N+](=O)[O-])C3=CC=CC=C3

Isomeric SMILES

CCOC(=O)NCC1C(C(=NO1)C2=C(C=CC=C2Cl)[N+](=O)[O-])C3=CC=CC=C3

InChI

InChI=1S/C19H18ClN3O5/c1-2-27-19(24)21-11-15-16(12-7-4-3-5-8-12)18(22-28-15)17-13(20)9-6-10-14(17)23(25)26/h3-10,15-16H,2,11H2,1H3,(H,21,24)