3-[3-[2,4-bis(oxidanyl)phenyl]propanoylamino]-4-oxidanylidene-4-piperazin-1-yl-butanamide hydrochloride

Systemtic Name: 3-[3-[2,4-bis(oxidanyl)phenyl]propanoylamino]-4-oxidanylidene-4-piperazin-1-yl-butanamide hydrochloride Openeye Name: 3-[3-(2,4-dihydroxyphenyl)propanoylamino]-4-oxo-4-piperazin-1-yl-butanamide hydrochloride CAS Name: 3-[[3-(2,4-dihydroxyphenyl)-1-oxopropyl]amino]-4-oxo-4-(1-piperazinyl)butanamide hydrochloride IUPAC Name: 3-[3-(2,4-dihydroxyphenyl)propanoylamino]-4-oxo-4-piperazin-1-ylbutanamide hydrochloride Traditional Name: 3-[3-(2,4-dihydroxyphenyl)propanoylamino]-4-keto-4-piperazino-butyramide hydrochloride Formula: C17H25ClN4O5 MolecularWeight: 400.8572

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1)C(=O)C(CC(=O)N)NC(=O)CCC2=C(C=C(C=C2)O)O.Cl

Isomeric SMILES

C1CN(CCN1)C(=O)C(CC(=O)N)NC(=O)CCC2=C(C=C(C=C2)O)O.Cl

InChI

InChI=1S/C17H24N4O5.ClH/c18-15(24)10-13(17(26)21-7-5-19-6-8-21)20-16(25)4-2-11-1-3-12(22)9-14(11)23;/h1,3,9,13,19,22-23H,2,4-8,10H2,(H2,18,24)(H,20,25);1H