methyl 2-[4-[(4-chloranyl-2-methoxy-5-methyl-phenyl)carbamoyl]piperidin-1-yl]sulfonylbenzoate

Systemtic Name: methyl 2-[4-[(4-chloranyl-2-methoxy-5-methyl-phenyl)carbamoyl]piperidin-1-yl]sulfonylbenzoate Openeye Name: methyl 2-[[4-[(4-chloro-2-methoxy-5-methyl-phenyl)carbamoyl]-1-piperidyl]sulfonyl]benzoate CAS Name: 2-[[4-[(4-chloro-2-methoxy-5-methylanilino)-oxomethyl]-1-piperidinyl]sulfonyl]benzoic acid methyl ester IUPAC Name: methyl 2-[4-[(4-chloro-2-methoxy-5-methylphenyl)carbamoyl]piperidin-1-yl]sulfonylbenzoate Traditional Name: 2-[4-[(4-chloro-2-methoxy-5-methyl-phenyl)carbamoyl]piperidino]sulfonylbenzoic acid methyl ester Formula: C22H25ClN2O6S MolecularWeight: 480.9617

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1Cl)OC)NC(=O)C2CCN(CC2)S(=O)(=O)C3=CC=CC=C3C(=O)OC

Isomeric SMILES

CC1=CC(=C(C=C1Cl)OC)NC(=O)C2CCN(CC2)S(=O)(=O)C3=CC=CC=C3C(=O)OC

InChI

InChI=1S/C22H25ClN2O6S/c1-14-12-18(19(30-2)13-17(14)23)24-21(26)15-8-10-25(11-9-15)32(28,29)20-7-5-4-6-16(20)22(27)31-3/h4-7,12-13,15H,8-11H2,1-3H3,(H,24,26)