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

Systemtic Name: O1-methyl O4-[(2S)-1-oxidanylidene-1-[[(2R)-4-phenylbutan-2-yl]amino]propan-2-yl] benzene-1,4-dicarboxylate Openeye Name: O1-methyl O4-[(1S)-1-methyl-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-[(2S)-1-oxo-1-[[(2R)-4-phenylbutan-2-yl]amino]propan-2-yl] ester IUPAC Name: 1-O-methyl 4-O-[(2S)-1-oxo-1-[[(2R)-4-phenylbutan-2-yl]amino]propan-2-yl] benzene-1,4-dicarboxylate Traditional Name: benzene-1,4-dicarboxylic acid O4-[(1S)-2-keto-1-methyl-2-[[(1R)-1-methyl-3-phenyl-propyl]amino]ethyl] ester O1-methyl ester Formula: C22H25NO5 MolecularWeight: 383.4376

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H25NO5/c1-15(9-10-17-7-5-4-6-8-17)23-20(24)16(2)28-22(26)19-13-11-18(12-14-19)21(25)27-3/h4-8,11-16H,9-10H2,1-3H3,(H,23,24)/t15-,16+/m1/s1