methyl 3-[(3-oxidanylidene-4H-1,4-benzoxazin-6-yl)sulfonylamino]-4-piperidin-1-yl-benzoate

Systemtic Name: methyl 3-[(3-oxidanylidene-4H-1,4-benzoxazin-6-yl)sulfonylamino]-4-piperidin-1-yl-benzoate Openeye Name: methyl 3-[(3-oxo-4H-1,4-benzoxazin-6-yl)sulfonylamino]-4-(1-piperidyl)benzoate CAS Name: 3-[(3-oxo-4H-1,4-benzoxazin-6-yl)sulfonylamino]-4-(1-piperidinyl)benzoic acid methyl ester IUPAC Name: methyl 3-[(3-oxo-4H-1,4-benzoxazin-6-yl)sulfonylamino]-4-piperidin-1-ylbenzoate Traditional Name: 3-[(3-keto-4H-1,4-benzoxazin-6-yl)sulfonylamino]-4-piperidino-benzoic acid methyl ester Formula: C21H23N3O6S MolecularWeight: 445.48882

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=C(C=C1)N2CCCCC2)NS(=O)(=O)C3=CC4=C(C=C3)OCC(=O)N4

Isomeric SMILES

COC(=O)C1=CC(=C(C=C1)N2CCCCC2)NS(=O)(=O)C3=CC4=C(C=C3)OCC(=O)N4

InChI

InChI=1S/C21H23N3O6S/c1-29-21(26)14-5-7-18(24-9-3-2-4-10-24)16(11-14)23-31(27,28)15-6-8-19-17(12-15)22-20(25)13-30-19/h5-8,11-12,23H,2-4,9-10,13H2,1H3,(H,22,25)