methyl (2R)-2-[[(3R)-3-methyl-5-oxidanylidene-5-(4-phenylpiperazin-1-yl)pentanoyl]amino]-3-phenyl-propanoate

Systemtic Name: methyl (2R)-2-[[(3R)-3-methyl-5-oxidanylidene-5-(4-phenylpiperazin-1-yl)pentanoyl]amino]-3-phenyl-propanoate Openeye Name: methyl (2R)-2-[[(3R)-3-methyl-5-oxo-5-(4-phenylpiperazin-1-yl)pentanoyl]amino]-3-phenyl-propanoate CAS Name: (2R)-2-[[(3R)-3-methyl-1,5-dioxo-5-(4-phenyl-1-piperazinyl)pentyl]amino]-3-phenylpropanoic acid methyl ester IUPAC Name: methyl (2R)-2-[[(3R)-3-methyl-5-oxo-5-(4-phenylpiperazin-1-yl)pentanoyl]amino]-3-phenylpropanoate Traditional Name: (2R)-2-[[(3R)-5-keto-3-methyl-5-(4-phenylpiperazino)pentanoyl]amino]-3-phenyl-propionic acid methyl ester Formula: C26H33N3O4 MolecularWeight: 451.55792

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC(=O)NC(CC1=CC=CC=C1)C(=O)OC)CC(=O)N2CCN(CC2)C3=CC=CC=C3

Isomeric SMILES

C[C@H](CC(=O)N[C@H](CC1=CC=CC=C1)C(=O)OC)CC(=O)N2CCN(CC2)C3=CC=CC=C3

InChI

InChI=1S/C26H33N3O4/c1-20(17-24(30)27-23(26(32)33-2)19-21-9-5-3-6-10-21)18-25(31)29-15-13-28(14-16-29)22-11-7-4-8-12-22/h3-12,20,23H,13-19H2,1-2H3,(H,27,30)/t20-,23-/m1/s1