methyl 4-[2-[[4-(2-methylpiperidin-1-yl)sulfonylphenyl]carbonylamino]ethyl]benzoate

Systemtic Name: methyl 4-[2-[[4-(2-methylpiperidin-1-yl)sulfonylphenyl]carbonylamino]ethyl]benzoate Openeye Name: methyl 4-[2-[[4-[(2-methyl-1-piperidyl)sulfonyl]benzoyl]amino]ethyl]benzoate CAS Name: 4-[2-[[[4-[(2-methyl-1-piperidinyl)sulfonyl]phenyl]-oxomethyl]amino]ethyl]benzoic acid methyl ester IUPAC Name: methyl 4-[2-[[4-(2-methylpiperidin-1-yl)sulfonylbenzoyl]amino]ethyl]benzoate Traditional Name: 4-[2-[[4-(2-methylpiperidino)sulfonylbenzoyl]amino]ethyl]benzoic acid methyl ester Formula: C23H28N2O5S MolecularWeight: 444.54382

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCCN1S(=O)(=O)C2=CC=C(C=C2)C(=O)NCCC3=CC=C(C=C3)C(=O)OC

Isomeric SMILES

CC1CCCCN1S(=O)(=O)C2=CC=C(C=C2)C(=O)NCCC3=CC=C(C=C3)C(=O)OC

InChI

InChI=1S/C23H28N2O5S/c1-17-5-3-4-16-25(17)31(28,29)21-12-10-19(11-13-21)22(26)24-15-14-18-6-8-20(9-7-18)23(27)30-2/h6-13,17H,3-5,14-16H2,1-2H3,(H,24,26)