5-[3,5-bis(oxidanylidene)piperazin-1-yl]pentyl 2-azanyl-3-(4-hydroxyphenyl)propanoate

Systemtic Name: 5-[3,5-bis(oxidanylidene)piperazin-1-yl]pentyl 2-azanyl-3-(4-hydroxyphenyl)propanoate Openeye Name: 5-(3,5-dioxopiperazin-1-yl)pentyl 2-amino-3-(4-hydroxyphenyl)propanoate CAS Name: 2-amino-3-(4-hydroxyphenyl)propanoic acid 5-(3,5-dioxo-1-piperazinyl)pentyl ester IUPAC Name: 5-(3,5-dioxopiperazin-1-yl)pentyl 2-amino-3-(4-hydroxyphenyl)propanoate Traditional Name: 2-amino-3-(4-hydroxyphenyl)propionic acid 5-(3,5-diketopiperazino)pentyl ester Formula: C18H25N3O5 MolecularWeight: 363.4082

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Descriptors Computed from Structure

Canonical SMILES:

C1C(=O)NC(=O)CN1CCCCCOC(=O)C(CC2=CC=C(C=C2)O)N

Isomeric SMILES

C1C(=O)NC(=O)CN1CCCCCOC(=O)C(CC2=CC=C(C=C2)O)N

InChI

InChI=1S/C18H25N3O5/c19-15(10-13-4-6-14(22)7-5-13)18(25)26-9-3-1-2-8-21-11-16(23)20-17(24)12-21/h4-7,15,22H,1-3,8-12,19H2,(H,20,23,24)