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

Systemtic Name: methyl (2R)-2-[2-[4-[(4-methoxyphenyl)methyl]piperazin-1-yl]ethanoylamino]-3-phenyl-propanoate Openeye Name: methyl (2R)-2-[[2-[4-[(4-methoxyphenyl)methyl]piperazin-1-yl]acetyl]amino]-3-phenyl-propanoate CAS Name: (2R)-2-[[2-[4-[(4-methoxyphenyl)methyl]-1-piperazinyl]-1-oxoethyl]amino]-3-phenylpropanoic acid methyl ester IUPAC Name: methyl (2R)-2-[[2-[4-[(4-methoxyphenyl)methyl]piperazin-1-yl]acetyl]amino]-3-phenylpropanoate Traditional Name: (2R)-2-[[2-(4-p-anisylpiperazino)acetyl]amino]-3-phenyl-propionic acid methyl ester Formula: C24H31N3O4 MolecularWeight: 425.52064

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CN2CCN(CC2)CC(=O)NC(CC3=CC=CC=C3)C(=O)OC

Isomeric SMILES

COC1=CC=C(C=C1)CN2CCN(CC2)CC(=O)N[C@H](CC3=CC=CC=C3)C(=O)OC

InChI

InChI=1S/C24H31N3O4/c1-30-21-10-8-20(9-11-21)17-26-12-14-27(15-13-26)18-23(28)25-22(24(29)31-2)16-19-6-4-3-5-7-19/h3-11,22H,12-18H2,1-2H3,(H,25,28)/t22-/m1/s1