ethyl 4-[4-[(3-aminocarbonylphenyl)carbamoyl]piperidin-1-yl]sulfonylbenzoate

Systemtic Name: ethyl 4-[4-[(3-aminocarbonylphenyl)carbamoyl]piperidin-1-yl]sulfonylbenzoate Openeye Name: ethyl 4-[[4-[(3-carbamoylphenyl)carbamoyl]-1-piperidyl]sulfonyl]benzoate CAS Name: 4-[[4-[(3-carbamoylanilino)-oxomethyl]-1-piperidinyl]sulfonyl]benzoic acid ethyl ester IUPAC Name: ethyl 4-[4-[(3-carbamoylphenyl)carbamoyl]piperidin-1-yl]sulfonylbenzoate Traditional Name: 4-[4-[(3-carbamoylphenyl)carbamoyl]piperidino]sulfonylbenzoic acid ethyl ester Formula: C22H25N3O6S MolecularWeight: 459.5154

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)S(=O)(=O)N2CCC(CC2)C(=O)NC3=CC=CC(=C3)C(=O)N

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)S(=O)(=O)N2CCC(CC2)C(=O)NC3=CC=CC(=C3)C(=O)N

InChI

InChI=1S/C22H25N3O6S/c1-2-31-22(28)16-6-8-19(9-7-16)32(29,30)25-12-10-15(11-13-25)21(27)24-18-5-3-4-17(14-18)20(23)26/h3-9,14-15H,2,10-13H2,1H3,(H2,23,26)(H,24,27)