1-piperazin-1-ylethyl 3-[2-(diphenylmethyl)oxyphenyl]-3-oxidanylidene-2-(phenylcarbamoylamino)propanoate

Systemtic Name: 1-piperazin-1-ylethyl 3-[2-(diphenylmethyl)oxyphenyl]-3-oxidanylidene-2-(phenylcarbamoylamino)propanoate Openeye Name: 1-piperazin-1-ylethyl 3-(2-benzhydryloxyphenyl)-3-oxo-2-(phenylcarbamoylamino)propanoate CAS Name: 2-[[anilino(oxo)methyl]amino]-3-[2-(diphenylmethyl)oxyphenyl]-3-oxopropanoic acid 1-(1-piperazinyl)ethyl ester IUPAC Name: 1-piperazin-1-ylethyl 3-(2-benzhydryloxyphenyl)-3-oxo-2-(phenylcarbamoylamino)propanoate Traditional Name: 3-(2-benzhydryloxyphenyl)-3-keto-2-(phenylcarbamoylamino)propionic acid 1-piperazinoethyl ester Formula: C35H36N4O5 MolecularWeight: 592.68414

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Descriptors Computed from Structure

Canonical SMILES:

CC(N1CCNCC1)OC(=O)C(C(=O)C2=CC=CC=C2OC(C3=CC=CC=C3)C4=CC=CC=C4)NC(=O)NC5=CC=CC=C5

Isomeric SMILES

CC(N1CCNCC1)OC(=O)C(C(=O)C2=CC=CC=C2OC(C3=CC=CC=C3)C4=CC=CC=C4)NC(=O)NC5=CC=CC=C5

InChI

InChI=1S/C35H36N4O5/c1-25(39-23-21-36-22-24-39)43-34(41)31(38-35(42)37-28-17-9-4-10-18-28)32(40)29-19-11-12-20-30(29)44-33(26-13-5-2-6-14-26)27-15-7-3-8-16-27/h2-20,25,31,33,36H,21-24H2,1H3,(H2,37,38,42)