3-azanyl-4-[3,5-bis[3,5-bis(oxidanylidene)piperazin-1-yl]pentoxy]-4-oxidanylidene-butanoic acid hydrochloride

Systemtic Name: 3-azanyl-4-[3,5-bis[3,5-bis(oxidanylidene)piperazin-1-yl]pentoxy]-4-oxidanylidene-butanoic acid hydrochloride Openeye Name: 3-amino-4-[3,5-bis(3,5-dioxopiperazin-1-yl)pentoxy]-4-oxo-butanoic acid hydrochloride CAS Name: 3-amino-4-[3,5-bis(3,5-dioxo-1-piperazinyl)pentoxy]-4-oxobutanoic acid hydrochloride IUPAC Name: 3-amino-4-[3,5-bis(3,5-dioxopiperazin-1-yl)pentoxy]-4-oxobutanoic acid hydrochloride Traditional Name: 3-amino-4-[3,5-bis(3,5-diketopiperazino)pentoxy]-4-keto-butyric acid hydrochloride Formula: C17H26ClN5O8 MolecularWeight: 463.87004

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Descriptors Computed from Structure

Canonical SMILES:

C1C(=O)NC(=O)CN1CCC(CCOC(=O)C(CC(=O)O)N)N2CC(=O)NC(=O)C2.Cl

Isomeric SMILES

C1C(=O)NC(=O)CN1CCC(CCOC(=O)C(CC(=O)O)N)N2CC(=O)NC(=O)C2.Cl

InChI

InChI=1S/C17H25N5O8.ClH/c18-11(5-16(27)28)17(29)30-4-2-10(22-8-14(25)20-15(26)9-22)1-3-21-6-12(23)19-13(24)7-21;/h10-11H,1-9,18H2,(H,27,28)(H,19,23,24)(H,20,25,26);1H