methyl (2S)-2-[[2-[(E)-3-methoxy-3-oxidanylidene-prop-1-enyl]phenyl]sulfonylamino]-3-phenyl-propanoate

Systemtic Name: methyl (2S)-2-[[2-[(E)-3-methoxy-3-oxidanylidene-prop-1-enyl]phenyl]sulfonylamino]-3-phenyl-propanoate Openeye Name: methyl (2S)-2-[[2-[(E)-3-methoxy-3-oxo-prop-1-enyl]phenyl]sulfonylamino]-3-phenyl-propanoate CAS Name: (2S)-2-[[2-[(E)-3-methoxy-3-oxoprop-1-enyl]phenyl]sulfonylamino]-3-phenylpropanoic acid methyl ester IUPAC Name: methyl (2S)-2-[[2-[(E)-3-methoxy-3-oxoprop-1-enyl]phenyl]sulfonylamino]-3-phenylpropanoate Traditional Name: (2S)-2-[[2-[(E)-3-keto-3-methoxy-prop-1-enyl]phenyl]sulfonylamino]-3-phenyl-propionic acid methyl ester Formula: C20H21NO6S MolecularWeight: 403.44884

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C=CC1=CC=CC=C1S(=O)(=O)NC(CC2=CC=CC=C2)C(=O)OC

Isomeric SMILES

COC(=O)/C=C/C1=CC=CC=C1S(=O)(=O)N[C@@H](CC2=CC=CC=C2)C(=O)OC

InChI

InChI=1S/C20H21NO6S/c1-26-19(22)13-12-16-10-6-7-11-18(16)28(24,25)21-17(20(23)27-2)14-15-8-4-3-5-9-15/h3-13,17,21H,14H2,1-2H3/b13-12+/t17-/m0/s1