methyl 2-[2-[4-(2-oxidanylidene-2-piperidin-1-yl-ethyl)piperazin-1-yl]ethanoylamino]-3-phenyl-propanoate

Systemtic Name: methyl 2-[2-[4-(2-oxidanylidene-2-piperidin-1-yl-ethyl)piperazin-1-yl]ethanoylamino]-3-phenyl-propanoate Openeye Name: methyl 2-[[2-[4-[2-oxo-2-(1-piperidyl)ethyl]piperazin-1-yl]acetyl]amino]-3-phenyl-propanoate CAS Name: 2-[[1-oxo-2-[4-[2-oxo-2-(1-piperidinyl)ethyl]-1-piperazinyl]ethyl]amino]-3-phenylpropanoic acid methyl ester IUPAC Name: methyl 2-[[2-[4-(2-oxo-2-piperidin-1-ylethyl)piperazin-1-yl]acetyl]amino]-3-phenylpropanoate Traditional Name: 2-[[2-[4-(2-keto-2-piperidino-ethyl)piperazino]acetyl]amino]-3-phenyl-propionic acid methyl ester Formula: C23H34N4O4 MolecularWeight: 430.54046

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(CC1=CC=CC=C1)NC(=O)CN2CCN(CC2)CC(=O)N3CCCCC3

Isomeric SMILES

COC(=O)C(CC1=CC=CC=C1)NC(=O)CN2CCN(CC2)CC(=O)N3CCCCC3

InChI

InChI=1S/C23H34N4O4/c1-31-23(30)20(16-19-8-4-2-5-9-19)24-21(28)17-25-12-14-26(15-13-25)18-22(29)27-10-6-3-7-11-27/h2,4-5,8-9,20H,3,6-7,10-18H2,1H3,(H,24,28)