methyl 4-methyl-1,1-bis(oxidanylidene)-2-phenyl-2,5-dihydro-1$l^{6},5-benzothiazepine-3-carboxylate

Systemtic Name: methyl 4-methyl-1,1-bis(oxidanylidene)-2-phenyl-2,5-dihydro-1$l^{6},5-benzothiazepine-3-carboxylate Openeye Name: methyl 4-methyl-1,1-dioxo-2-phenyl-2,5-dihydro-1$l^{6},5-benzothiazepine-3-carboxylate CAS Name: 4-methyl-1,1-dioxo-2-phenyl-2,5-dihydro-1$l^{6},5-benzothiazepine-3-carboxylic acid methyl ester IUPAC Name: methyl 4-methyl-1,1-dioxo-2-phenyl-2,5-dihydro-1$l^{6},5-benzothiazepine-3-carboxylate Traditional Name: 1,1-diketo-4-methyl-2-phenyl-2,5-dihydro-1$l^{6},5-benzothiazepine-3-carboxylic acid methyl ester Formula: C18H17NO4S MolecularWeight: 343.39688

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(S(=O)(=O)C2=CC=CC=C2N1)C3=CC=CC=C3)C(=O)OC

Isomeric SMILES

CC1=C(C(S(=O)(=O)C2=CC=CC=C2N1)C3=CC=CC=C3)C(=O)OC

InChI

InChI=1S/C18H17NO4S/c1-12-16(18(20)23-2)17(13-8-4-3-5-9-13)24(21,22)15-11-7-6-10-14(15)19-12/h3-11,17,19H,1-2H3