ethyl 3-chloranyl-4-[[4-(phenylsulfonyl)-2,3-dihydro-1,4-benzoxazin-2-yl]carbonylamino]benzoate

Systemtic Name: ethyl 3-chloranyl-4-[[4-(phenylsulfonyl)-2,3-dihydro-1,4-benzoxazin-2-yl]carbonylamino]benzoate Openeye Name: ethyl 4-[[4-(benzenesulfonyl)-2,3-dihydro-1,4-benzoxazine-2-carbonyl]amino]-3-chloro-benzoate CAS Name: 4-[[[4-(benzenesulfonyl)-2,3-dihydro-1,4-benzoxazin-2-yl]-oxomethyl]amino]-3-chlorobenzoic acid ethyl ester IUPAC Name: ethyl 4-[[4-(benzenesulfonyl)-2,3-dihydro-1,4-benzoxazine-2-carbonyl]amino]-3-chlorobenzoate Traditional Name: 4-[(4-besyl-2,3-dihydro-1,4-benzoxazine-2-carbonyl)amino]-3-chloro-benzoic acid ethyl ester Formula: C24H21ClN2O6S MolecularWeight: 500.95134

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC(=C(C=C1)NC(=O)C2CN(C3=CC=CC=C3O2)S(=O)(=O)C4=CC=CC=C4)Cl

Isomeric SMILES

CCOC(=O)C1=CC(=C(C=C1)NC(=O)C2CN(C3=CC=CC=C3O2)S(=O)(=O)C4=CC=CC=C4)Cl

InChI

InChI=1S/C24H21ClN2O6S/c1-2-32-24(29)16-12-13-19(18(25)14-16)26-23(28)22-15-27(20-10-6-7-11-21(20)33-22)34(30,31)17-8-4-3-5-9-17/h3-14,22H,2,15H2,1H3,(H,26,28)