2,6-bis(azanyl)hexanoic acid; 3-[(E)-4-methylpent-2-enoyl]-4-oxidanyl-2H-furan-5-one

Systemtic Name: 2,6-bis(azanyl)hexanoic acid; 3-[(E)-4-methylpent-2-enoyl]-4-oxidanyl-2H-furan-5-one Openeye Name: 2,6-diaminohexanoic acid; 4-hydroxy-3-[(E)-4-methylpent-2-enoyl]-2H-furan-5-one CAS Name: 2,6-diaminohexanoic acid; 4-hydroxy-3-[(E)-4-methyl-1-oxopent-2-enyl]-2H-furan-5-one IUPAC Name: 2,6-diaminohexanoic acid; 4-hydroxy-3-[(E)-4-methylpent-2-enoyl]-2H-furan-5-one Traditional Name: 2,6-diaminohexanoic acid; 4-hydroxy-3-[(E)-4-methylpent-2-enoyl]-2H-furan-5-one Formula: C16H26N2O6 MolecularWeight: 342.38744

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C=CC(=O)C1=C(C(=O)OC1)O.C(CCN)CC(C(=O)O)N

Isomeric SMILES

CC(C)/C=C/C(=O)C1=C(C(=O)OC1)O.C(CCN)CC(C(=O)O)N

InChI

InChI=1S/C10H12O4.C6H14N2O2/c1-6(2)3-4-8(11)7-5-14-10(13)9(7)12;7-4-2-1-3-5(8)6(9)10/h3-4,6,12H,5H2,1-2H3;5H,1-4,7-8H2,(H,9,10)/b4-3+;