6-(4-azanyl-3-oxidanyl-butyl)-1-[3-(3-methoxy-4-oxidanyl-phenyl)propyl]piperazine-2,5-dione

Systemtic Name: 6-(4-azanyl-3-oxidanyl-butyl)-1-[3-(3-methoxy-4-oxidanyl-phenyl)propyl]piperazine-2,5-dione Openeye Name: 6-(4-amino-3-hydroxy-butyl)-1-[3-(4-hydroxy-3-methoxy-phenyl)propyl]piperazine-2,5-dione CAS Name: 6-(4-amino-3-hydroxybutyl)-1-[3-(4-hydroxy-3-methoxyphenyl)propyl]piperazine-2,5-dione IUPAC Name: 6-(4-amino-3-hydroxybutyl)-1-[3-(4-hydroxy-3-methoxyphenyl)propyl]piperazine-2,5-dione Traditional Name: 6-(4-amino-3-hydroxy-butyl)-1-[3-(4-hydroxy-3-methoxy-phenyl)propyl]piperazine-2,5-quinone Formula: C18H27N3O5 MolecularWeight: 365.42408

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)CCCN2C(C(=O)NCC2=O)CCC(CN)O)O

Isomeric SMILES

COC1=C(C=CC(=C1)CCCN2C(C(=O)NCC2=O)CCC(CN)O)O

InChI

InChI=1S/C18H27N3O5/c1-26-16-9-12(4-7-15(16)23)3-2-8-21-14(6-5-13(22)10-19)18(25)20-11-17(21)24/h4,7,9,13-14,22-23H,2-3,5-6,8,10-11,19H2,1H3,(H,20,25)