(2S,7R)-2-azanyl-3-oxidanylidene-7-prop-2-enyl-6-propoxycarbonyl-2,7-dihydro-1H-pyrazolo[1,2-a]pyrazole-5-carboxylic acid

Systemtic Name: (2S,7R)-2-azanyl-3-oxidanylidene-7-prop-2-enyl-6-propoxycarbonyl-2,7-dihydro-1H-pyrazolo[1,2-a]pyrazole-5-carboxylic acid Openeye Name: (2S,7R)-7-allyl-2-amino-3-oxo-6-propoxycarbonyl-2,7-dihydro-1H-pyrazolo[1,2-a]pyrazole-5-carboxylic acid CAS Name: (2S,7R)-2-amino-3-oxo-6-[oxo(propoxy)methyl]-7-prop-2-enyl-2,7-dihydro-1H-pyrazolo[1,2-a]pyrazole-5-carboxylic acid IUPAC Name: (2S,7R)-2-amino-3-oxo-7-prop-2-enyl-6-propoxycarbonyl-2,7-dihydro-1H-pyrazolo[1,2-a]pyrazole-5-carboxylic acid Traditional Name: (2S,7R)-7-allyl-2-amino-3-keto-6-propoxycarbonyl-2,7-dihydro-1H-pyrazolo[1,2-a]pyrazole-5-carboxylic acid Formula: C14H19N3O5 MolecularWeight: 309.31776

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC(=O)C1=C(N2C(=O)C(CN2C1CC=C)N)C(=O)O

Isomeric SMILES

CCCOC(=O)C1=C(N2C(=O)[C@H](CN2[C@@H]1CC=C)N)C(=O)O

InChI

InChI=1S/C14H19N3O5/c1-3-5-9-10(14(21)22-6-4-2)11(13(19)20)17-12(18)8(15)7-16(9)17/h3,8-9H,1,4-7,15H2,2H3,(H,19,20)/t8-,9+/m0/s1