3-[(6-chloranyl-3-oxidanylidene-4H-1,4-benzoxazin-7-yl)sulfonyl]-N-ethyl-N-(phenylmethyl)propanamide

Systemtic Name: 3-[(6-chloranyl-3-oxidanylidene-4H-1,4-benzoxazin-7-yl)sulfonyl]-N-ethyl-N-(phenylmethyl)propanamide Openeye Name: N-benzyl-3-[(6-chloro-3-oxo-4H-1,4-benzoxazin-7-yl)sulfonyl]-N-ethyl-propanamide CAS Name: 3-[(6-chloro-3-oxo-4H-1,4-benzoxazin-7-yl)sulfonyl]-N-ethyl-N-(phenylmethyl)propanamide IUPAC Name: N-benzyl-3-[(6-chloro-3-oxo-4H-1,4-benzoxazin-7-yl)sulfonyl]-N-ethylpropanamide Traditional Name: N-benzyl-3-[(6-chloro-3-keto-4H-1,4-benzoxazin-7-yl)sulfonyl]-N-ethyl-propionamide Formula: C20H21ClN2O5S MolecularWeight: 436.90914

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC1=CC=CC=C1)C(=O)CCS(=O)(=O)C2=C(C=C3C(=C2)OCC(=O)N3)Cl

Isomeric SMILES

CCN(CC1=CC=CC=C1)C(=O)CCS(=O)(=O)C2=C(C=C3C(=C2)OCC(=O)N3)Cl

InChI

InChI=1S/C20H21ClN2O5S/c1-2-23(12-14-6-4-3-5-7-14)20(25)8-9-29(26,27)18-11-17-16(10-15(18)21)22-19(24)13-28-17/h3-7,10-11H,2,8-9,12-13H2,1H3,(H,22,24)