methyl 1-[3-(3-oxidanylidene-1,4-benzothiazin-4-yl)propanoyl]-4-phenyl-piperidine-4-carboxylate

Systemtic Name: methyl 1-[3-(3-oxidanylidene-1,4-benzothiazin-4-yl)propanoyl]-4-phenyl-piperidine-4-carboxylate Openeye Name: methyl 1-[3-(3-oxo-1,4-benzothiazin-4-yl)propanoyl]-4-phenyl-piperidine-4-carboxylate CAS Name: 1-[1-oxo-3-(3-oxo-1,4-benzothiazin-4-yl)propyl]-4-phenyl-4-piperidinecarboxylic acid methyl ester IUPAC Name: methyl 1-[3-(3-oxo-1,4-benzothiazin-4-yl)propanoyl]-4-phenylpiperidine-4-carboxylate Traditional Name: 1-[3-(3-keto-1,4-benzothiazin-4-yl)propanoyl]-4-phenyl-isonipecotic acid methyl ester Formula: C24H26N2O4S MolecularWeight: 438.53924

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1(CCN(CC1)C(=O)CCN2C(=O)CSC3=CC=CC=C32)C4=CC=CC=C4

Isomeric SMILES

COC(=O)C1(CCN(CC1)C(=O)CCN2C(=O)CSC3=CC=CC=C32)C4=CC=CC=C4

InChI

InChI=1S/C24H26N2O4S/c1-30-23(29)24(18-7-3-2-4-8-18)12-15-25(16-13-24)21(27)11-14-26-19-9-5-6-10-20(19)31-17-22(26)28/h2-10H,11-17H2,1H3