ethyl 5-methyl-2,4-bis(oxidanylidene)-3-(phenylmethyl)-1H-pyrrolo[3,2-d]pyrimidine-7-carboxylate

Systemtic Name: ethyl 5-methyl-2,4-bis(oxidanylidene)-3-(phenylmethyl)-1H-pyrrolo[3,2-d]pyrimidine-7-carboxylate Openeye Name: ethyl 3-benzyl-5-methyl-2,4-dioxo-1H-pyrrolo[3,2-d]pyrimidine-7-carboxylate CAS Name: 5-methyl-2,4-dioxo-3-(phenylmethyl)-1H-pyrrolo[3,2-d]pyrimidine-7-carboxylic acid ethyl ester IUPAC Name: ethyl 3-benzyl-5-methyl-2,4-dioxo-1H-pyrrolo[3,2-d]pyrimidine-7-carboxylate Traditional Name: 3-benzyl-2,4-diketo-5-methyl-1H-pyrrolo[3,2-d]pyrimidine-7-carboxylic acid ethyl ester Formula: C17H17N3O4 MolecularWeight: 327.33458

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CN(C2=C1NC(=O)N(C2=O)CC3=CC=CC=C3)C

Isomeric SMILES

CCOC(=O)C1=CN(C2=C1NC(=O)N(C2=O)CC3=CC=CC=C3)C

InChI

InChI=1S/C17H17N3O4/c1-3-24-16(22)12-10-19(2)14-13(12)18-17(23)20(15(14)21)9-11-7-5-4-6-8-11/h4-8,10H,3,9H2,1-2H3,(H,18,23)