methyl 3-(1-ethyl-3-methyl-8-oxidanylidene-6,7-dihydropyrazolo[4,3-e][1,4]diazepin-5-yl)propanoate

Systemtic Name: methyl 3-(1-ethyl-3-methyl-8-oxidanylidene-6,7-dihydropyrazolo[4,3-e][1,4]diazepin-5-yl)propanoate Openeye Name: methyl 3-(1-ethyl-3-methyl-8-oxo-6,7-dihydropyrazolo[4,3-e][1,4]diazepin-5-yl)propanoate CAS Name: 3-(1-ethyl-3-methyl-8-oxo-6,7-dihydropyrazolo[4,3-e][1,4]diazepin-5-yl)propanoic acid methyl ester IUPAC Name: methyl 3-(1-ethyl-3-methyl-8-oxo-6,7-dihydropyrazolo[4,3-e][1,4]diazepin-5-yl)propanoate Traditional Name: 3-(1-ethyl-8-keto-3-methyl-6,7-dihydropyrazolo[4,3-e][1,4]diazepin-5-yl)propionic acid methyl ester Formula: C13H18N4O3 MolecularWeight: 278.30702

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C(=N1)C)N=C(CNC2=O)CCC(=O)OC

Isomeric SMILES

CCN1C2=C(C(=N1)C)N=C(CNC2=O)CCC(=O)OC

InChI

InChI=1S/C13H18N4O3/c1-4-17-12-11(8(2)16-17)15-9(7-14-13(12)19)5-6-10(18)20-3/h4-7H2,1-3H3,(H,14,19)