methyl (2R)-2-[2-[4-(2-methylphenyl)piperazin-1-yl]ethanoylamino]-3-phenyl-propanoate

Systemtic Name: methyl (2R)-2-[2-[4-(2-methylphenyl)piperazin-1-yl]ethanoylamino]-3-phenyl-propanoate Openeye Name: methyl (2R)-2-[[2-[4-(o-tolyl)piperazin-1-yl]acetyl]amino]-3-phenyl-propanoate CAS Name: (2R)-2-[[2-[4-(2-methylphenyl)-1-piperazinyl]-1-oxoethyl]amino]-3-phenylpropanoic acid methyl ester IUPAC Name: methyl (2R)-2-[[2-[4-(2-methylphenyl)piperazin-1-yl]acetyl]amino]-3-phenylpropanoate Traditional Name: (2R)-2-[[2-[4-(o-tolyl)piperazino]acetyl]amino]-3-phenyl-propionic acid methyl ester Formula: C23H29N3O3 MolecularWeight: 395.49466

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1N2CCN(CC2)CC(=O)NC(CC3=CC=CC=C3)C(=O)OC

Isomeric SMILES

CC1=CC=CC=C1N2CCN(CC2)CC(=O)N[C@H](CC3=CC=CC=C3)C(=O)OC

InChI

InChI=1S/C23H29N3O3/c1-18-8-6-7-11-21(18)26-14-12-25(13-15-26)17-22(27)24-20(23(28)29-2)16-19-9-4-3-5-10-19/h3-11,20H,12-17H2,1-2H3,(H,24,27)/t20-/m1/s1