methyl 3-[[3-(3,5-dimethylpiperidin-1-yl)sulfonylphenyl]carbonylamino]-3-phenyl-propanoate

Systemtic Name: methyl 3-[[3-(3,5-dimethylpiperidin-1-yl)sulfonylphenyl]carbonylamino]-3-phenyl-propanoate Openeye Name: methyl 3-[[3-[(3,5-dimethyl-1-piperidyl)sulfonyl]benzoyl]amino]-3-phenyl-propanoate CAS Name: 3-[[[3-[(3,5-dimethyl-1-piperidinyl)sulfonyl]phenyl]-oxomethyl]amino]-3-phenylpropanoic acid methyl ester IUPAC Name: methyl 3-[[3-(3,5-dimethylpiperidin-1-yl)sulfonylbenzoyl]amino]-3-phenylpropanoate Traditional Name: 3-[[3-(3,5-dimethylpiperidino)sulfonylbenzoyl]amino]-3-phenyl-propionic acid methyl ester Formula: C24H30N2O5S MolecularWeight: 458.5704

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C24H30N2O5S/c1-17-12-18(2)16-26(15-17)32(29,30)21-11-7-10-20(13-21)24(28)25-22(14-23(27)31-3)19-8-5-4-6-9-19/h4-11,13,17-18,22H,12,14-16H2,1-3H3,(H,25,28)