methyl 4-[[4-(3,5-dimethylpiperidin-1-yl)sulfonylphenyl]carbamoyl]benzoate

Systemtic Name: methyl 4-[[4-(3,5-dimethylpiperidin-1-yl)sulfonylphenyl]carbamoyl]benzoate Openeye Name: methyl 4-[[4-[(3,5-dimethyl-1-piperidyl)sulfonyl]phenyl]carbamoyl]benzoate CAS Name: 4-[[4-[(3,5-dimethyl-1-piperidinyl)sulfonyl]anilino]-oxomethyl]benzoic acid methyl ester IUPAC Name: methyl 4-[[4-(3,5-dimethylpiperidin-1-yl)sulfonylphenyl]carbamoyl]benzoate Traditional Name: 4-[[4-(3,5-dimethylpiperidino)sulfonylphenyl]carbamoyl]benzoic acid methyl ester Formula: C22H26N2O5S MolecularWeight: 430.51724

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(CN(C1)S(=O)(=O)C2=CC=C(C=C2)NC(=O)C3=CC=C(C=C3)C(=O)OC)C

Isomeric SMILES

CC1CC(CN(C1)S(=O)(=O)C2=CC=C(C=C2)NC(=O)C3=CC=C(C=C3)C(=O)OC)C

InChI

InChI=1S/C22H26N2O5S/c1-15-12-16(2)14-24(13-15)30(27,28)20-10-8-19(9-11-20)23-21(25)17-4-6-18(7-5-17)22(26)29-3/h4-11,15-16H,12-14H2,1-3H3,(H,23,25)