ethyl 3-[[1-[(2-oxidanylidene-3H-1,3-benzoxazol-6-yl)sulfonyl]piperidin-3-yl]carbonylamino]benzoate

Systemtic Name: ethyl 3-[[1-[(2-oxidanylidene-3H-1,3-benzoxazol-6-yl)sulfonyl]piperidin-3-yl]carbonylamino]benzoate Openeye Name: ethyl 3-[[1-[(2-oxo-3H-1,3-benzoxazol-6-yl)sulfonyl]piperidine-3-carbonyl]amino]benzoate CAS Name: 3-[[oxo-[1-[(2-oxo-3H-1,3-benzoxazol-6-yl)sulfonyl]-3-piperidinyl]methyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 3-[[1-[(2-oxo-3H-1,3-benzoxazol-6-yl)sulfonyl]piperidine-3-carbonyl]amino]benzoate Traditional Name: 3-[[1-[(2-keto-3H-1,3-benzoxazol-6-yl)sulfonyl]nipecotoyl]amino]benzoic acid ethyl ester Formula: C22H23N3O7S MolecularWeight: 473.49892

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC(=CC=C1)NC(=O)C2CCCN(C2)S(=O)(=O)C3=CC4=C(C=C3)NC(=O)O4

Isomeric SMILES

CCOC(=O)C1=CC(=CC=C1)NC(=O)C2CCCN(C2)S(=O)(=O)C3=CC4=C(C=C3)NC(=O)O4

InChI

InChI=1S/C22H23N3O7S/c1-2-31-21(27)14-5-3-7-16(11-14)23-20(26)15-6-4-10-25(13-15)33(29,30)17-8-9-18-19(12-17)32-22(28)24-18/h3,5,7-9,11-12,15H,2,4,6,10,13H2,1H3,(H,23,26)(H,24,28)