O1-ethyl O7-methyl (E)-6-azanyl-2-(2-formamidoethanoylamino)hept-3-enedioate

Systemtic Name: O1-ethyl O7-methyl (E)-6-azanyl-2-(2-formamidoethanoylamino)hept-3-enedioate Openeye Name: O1-ethyl O7-methyl (E)-6-amino-2-[(2-formamidoacetyl)amino]hept-3-enedioate CAS Name: (E)-6-amino-2-[(2-formamido-1-oxoethyl)amino]-3-heptenedioic acid O1-ethyl ester O7-methyl ester IUPAC Name: 1-O-ethyl 7-O-methyl (E)-6-amino-2-[(2-formamidoacetyl)amino]hept-3-enedioate Traditional Name: (E)-6-amino-2-[(2-formamidoacetyl)amino]hept-3-enedioic acid O1-ethyl ester O7-methyl ester Formula: C13H21N3O6 MolecularWeight: 315.32234

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C=CCC(C(=O)OC)N)NC(=O)CNC=O

Isomeric SMILES

CCOC(=O)C(/C=C/CC(C(=O)OC)N)NC(=O)CNC=O

InChI

InChI=1S/C13H21N3O6/c1-3-22-13(20)10(16-11(18)7-15-8-17)6-4-5-9(14)12(19)21-2/h4,6,8-10H,3,5,7,14H2,1-2H3,(H,15,17)(H,16,18)/b6-4+