6-ethyl-4-oxidanylidene-3-(phenylmethoxycarbonylamino)-7,8-dihydropyrrolo[1,2-a]pyrimidine-6-carboxylic acid

Systemtic Name: 6-ethyl-4-oxidanylidene-3-(phenylmethoxycarbonylamino)-7,8-dihydropyrrolo[1,2-a]pyrimidine-6-carboxylic acid Openeye Name: 3-(benzyloxycarbonylamino)-6-ethyl-4-oxo-7,8-dihydropyrrolo[1,2-a]pyrimidine-6-carboxylic acid CAS Name: 6-ethyl-4-oxo-3-(phenylmethoxycarbonylamino)-7,8-dihydropyrrolo[1,2-a]pyrimidine-6-carboxylic acid IUPAC Name: 6-ethyl-4-oxo-3-(phenylmethoxycarbonylamino)-7,8-dihydropyrrolo[1,2-a]pyrimidine-6-carboxylic acid Traditional Name: 3-(benzyloxycarbonylamino)-6-ethyl-4-keto-7,8-dihydropyrrolo[1,2-a]pyrimidine-6-carboxylic acid Formula: C18H19N3O5 MolecularWeight: 357.36056

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Descriptors Computed from Structure

Canonical SMILES:

CCC1(CCC2=NC=C(C(=O)N21)NC(=O)OCC3=CC=CC=C3)C(=O)O

Isomeric SMILES

CCC1(CCC2=NC=C(C(=O)N21)NC(=O)OCC3=CC=CC=C3)C(=O)O

InChI

InChI=1S/C18H19N3O5/c1-2-18(16(23)24)9-8-14-19-10-13(15(22)21(14)18)20-17(25)26-11-12-6-4-3-5-7-12/h3-7,10H,2,8-9,11H2,1H3,(H,20,25)(H,23,24)