O1-methyl O4-[2-oxidanylidene-2-[[(2R)-4-phenylbutan-2-yl]amino]ethyl] benzene-1,4-dicarboxylate

Systemtic Name: O1-methyl O4-[2-oxidanylidene-2-[[(2R)-4-phenylbutan-2-yl]amino]ethyl] benzene-1,4-dicarboxylate Openeye Name: O1-methyl O4-[2-[[(1R)-1-methyl-3-phenyl-propyl]amino]-2-oxo-ethyl] benzene-1,4-dicarboxylate CAS Name: benzene-1,4-dicarboxylic acid O1-methyl ester O4-[2-oxo-2-[[(2R)-4-phenylbutan-2-yl]amino]ethyl] ester IUPAC Name: 1-O-methyl 4-O-[2-oxo-2-[[(2R)-4-phenylbutan-2-yl]amino]ethyl] benzene-1,4-dicarboxylate Traditional Name: benzene-1,4-dicarboxylic acid O4-[2-keto-2-[[(1R)-1-methyl-3-phenyl-propyl]amino]ethyl] ester O1-methyl ester Formula: C21H23NO5 MolecularWeight: 369.41102

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCC1=CC=CC=C1)NC(=O)COC(=O)C2=CC=C(C=C2)C(=O)OC

Isomeric SMILES

C[C@H](CCC1=CC=CC=C1)NC(=O)COC(=O)C2=CC=C(C=C2)C(=O)OC

InChI

InChI=1S/C21H23NO5/c1-15(8-9-16-6-4-3-5-7-16)22-19(23)14-27-21(25)18-12-10-17(11-13-18)20(24)26-2/h3-7,10-13,15H,8-9,14H2,1-2H3,(H,22,23)/t15-/m1/s1