N-(3-chloranyl-4-methoxy-phenyl)-4-(phenylmethyl)sulfonyl-2,3-dihydro-1,4-benzoxazine-2-carboxamide

Systemtic Name: N-(3-chloranyl-4-methoxy-phenyl)-4-(phenylmethyl)sulfonyl-2,3-dihydro-1,4-benzoxazine-2-carboxamide Openeye Name: 4-benzylsulfonyl-N-(3-chloro-4-methoxy-phenyl)-2,3-dihydro-1,4-benzoxazine-2-carboxamide CAS Name: N-(3-chloro-4-methoxyphenyl)-4-(phenylmethyl)sulfonyl-2,3-dihydro-1,4-benzoxazine-2-carboxamide IUPAC Name: 4-benzylsulfonyl-N-(3-chloro-4-methoxyphenyl)-2,3-dihydro-1,4-benzoxazine-2-carboxamide Traditional Name: 4-benzylsulfonyl-N-(3-chloro-4-methoxy-phenyl)-2,3-dihydro-1,4-benzoxazine-2-carboxamide Formula: C23H21ClN2O5S MolecularWeight: 472.94124

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)NC(=O)C2CN(C3=CC=CC=C3O2)S(=O)(=O)CC4=CC=CC=C4)Cl

Isomeric SMILES

COC1=C(C=C(C=C1)NC(=O)C2CN(C3=CC=CC=C3O2)S(=O)(=O)CC4=CC=CC=C4)Cl

InChI

InChI=1S/C23H21ClN2O5S/c1-30-20-12-11-17(13-18(20)24)25-23(27)22-14-26(19-9-5-6-10-21(19)31-22)32(28,29)15-16-7-3-2-4-8-16/h2-13,22H,14-15H2,1H3,(H,25,27)