4-(2-dimethylaminoethyl)-7-(phenylsulfonyl)-1,4-benzoxazin-3-one

Systemtic Name: 4-(2-dimethylaminoethyl)-7-(phenylsulfonyl)-1,4-benzoxazin-3-one Openeye Name: 7-(benzenesulfonyl)-4-(2-dimethylaminoethyl)-1,4-benzoxazin-3-one CAS Name: 7-(benzenesulfonyl)-4-(2-dimethylaminoethyl)-1,4-benzoxazin-3-one IUPAC Name: 7-(benzenesulfonyl)-4-(2-dimethylaminoethyl)-1,4-benzoxazin-3-one Traditional Name: 7-besyl-4-(2-dimethylaminoethyl)-1,4-benzoxazin-3-one Formula: C18H20N2O4S MolecularWeight: 360.4274

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CCN1C(=O)COC2=C1C=CC(=C2)S(=O)(=O)C3=CC=CC=C3

Isomeric SMILES

CN(C)CCN1C(=O)COC2=C1C=CC(=C2)S(=O)(=O)C3=CC=CC=C3

InChI

InChI=1S/C18H20N2O4S/c1-19(2)10-11-20-16-9-8-15(12-17(16)24-13-18(20)21)25(22,23)14-6-4-3-5-7-14/h3-9,12H,10-11,13H2,1-2H3