methyl 2-[(3-methylsulfonylphenyl)carbonylamino]-3-phenyl-propanoate

Systemtic Name: methyl 2-[(3-methylsulfonylphenyl)carbonylamino]-3-phenyl-propanoate Openeye Name: methyl 2-[(3-methylsulfonylbenzoyl)amino]-3-phenyl-propanoate CAS Name: 2-[[(3-methylsulfonylphenyl)-oxomethyl]amino]-3-phenylpropanoic acid methyl ester IUPAC Name: methyl 2-[(3-methylsulfonylbenzoyl)amino]-3-phenylpropanoate Traditional Name: 2-[(3-mesylbenzoyl)amino]-3-phenyl-propionic acid methyl ester Formula: C18H19NO5S MolecularWeight: 361.41216

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(CC1=CC=CC=C1)NC(=O)C2=CC(=CC=C2)S(=O)(=O)C

Isomeric SMILES

COC(=O)C(CC1=CC=CC=C1)NC(=O)C2=CC(=CC=C2)S(=O)(=O)C

InChI

InChI=1S/C18H19NO5S/c1-24-18(21)16(11-13-7-4-3-5-8-13)19-17(20)14-9-6-10-15(12-14)25(2,22)23/h3-10,12,16H,11H2,1-2H3,(H,19,20)