methyl 4-oxidanylidene-4-[4-[2-oxidanylidene-2-[(phenylmethyl)amino]ethyl]piperazin-1-yl]butanoate

Systemtic Name: methyl 4-oxidanylidene-4-[4-[2-oxidanylidene-2-[(phenylmethyl)amino]ethyl]piperazin-1-yl]butanoate Openeye Name: methyl 4-[4-[2-(benzylamino)-2-oxo-ethyl]piperazin-1-yl]-4-oxo-butanoate CAS Name: 4-oxo-4-[4-[2-oxo-2-[(phenylmethyl)amino]ethyl]-1-piperazinyl]butanoic acid methyl ester IUPAC Name: methyl 4-[4-[2-(benzylamino)-2-oxoethyl]piperazin-1-yl]-4-oxobutanoate Traditional Name: 4-[4-[2-(benzylamino)-2-keto-ethyl]piperazino]-4-keto-butyric acid methyl ester Formula: C18H25N3O4 MolecularWeight: 347.4088

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCC(=O)N1CCN(CC1)CC(=O)NCC2=CC=CC=C2

Isomeric SMILES

COC(=O)CCC(=O)N1CCN(CC1)CC(=O)NCC2=CC=CC=C2

InChI

InChI=1S/C18H25N3O4/c1-25-18(24)8-7-17(23)21-11-9-20(10-12-21)14-16(22)19-13-15-5-3-2-4-6-15/h2-6H,7-14H2,1H3,(H,19,22)