[1-[(4-methoxyphenyl)methylamino]-1-oxidanylidene-propan-2-yl] (2S)-2-[(4-methylphenyl)sulfonylamino]propanoate

Systemtic Name: [1-[(4-methoxyphenyl)methylamino]-1-oxidanylidene-propan-2-yl] (2S)-2-[(4-methylphenyl)sulfonylamino]propanoate Openeye Name: [2-[(4-methoxyphenyl)methylamino]-1-methyl-2-oxo-ethyl] (2S)-2-(p-tolylsulfonylamino)propanoate CAS Name: (2S)-2-[(4-methylphenyl)sulfonylamino]propanoic acid [1-[(4-methoxyphenyl)methylamino]-1-oxopropan-2-yl] ester IUPAC Name: [1-[(4-methoxyphenyl)methylamino]-1-oxopropan-2-yl] (2S)-2-[(4-methylphenyl)sulfonylamino]propanoate Traditional Name: (2S)-2-(tosylamino)propionic acid [2-keto-1-methyl-2-(p-anisylamino)ethyl] ester Formula: C21H26N2O6S MolecularWeight: 434.50594

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NC(C)C(=O)OC(C)C(=O)NCC2=CC=C(C=C2)OC

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N[C@@H](C)C(=O)OC(C)C(=O)NCC2=CC=C(C=C2)OC

InChI

InChI=1S/C21H26N2O6S/c1-14-5-11-19(12-6-14)30(26,27)23-15(2)21(25)29-16(3)20(24)22-13-17-7-9-18(28-4)10-8-17/h5-12,15-16,23H,13H2,1-4H3,(H,22,24)/t15-,16?/m0/s1