(6-acetamido-5-azanylidene-7-methyl-8-oxidanylidene-2,3-dihydro-1H-pyrrolo[1,2-a]benzimidazol-3-yl) pentanoate

Systemtic Name: (6-acetamido-5-azanylidene-7-methyl-8-oxidanylidene-2,3-dihydro-1H-pyrrolo[1,2-a]benzimidazol-3-yl) pentanoate Openeye Name: (6-acetamido-5-imino-7-methyl-8-oxo-2,3-dihydro-1H-pyrrolo[1,2-a]benzimidazol-3-yl) pentanoate CAS Name: pentanoic acid (6-acetamido-5-imino-7-methyl-8-oxo-2,3-dihydro-1H-pyrrolo[1,2-a]benzimidazol-3-yl) ester IUPAC Name: (6-acetamido-5-imino-7-methyl-8-oxo-2,3-dihydro-1H-pyrrolo[1,2-a]benzimidazol-3-yl) pentanoate Traditional Name: valeric acid (6-acetamido-5-imino-8-keto-7-methyl-2,3-dihydro-1H-pyrrolo[1,2-a]benzimidazol-3-yl) ester Formula: C18H22N4O4 MolecularWeight: 358.39168

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(=O)OC1CCN2C1=NC3=C2C(=O)C(=C(C3=N)NC(=O)C)C

Isomeric SMILES

CCCCC(=O)OC1CCN2C1=NC3=C2C(=O)C(=C(C3=N)NC(=O)C)C

InChI

InChI=1S/C18H22N4O4/c1-4-5-6-12(24)26-11-7-8-22-16-15(21-18(11)22)13(19)14(20-10(3)23)9(2)17(16)25/h11,19H,4-8H2,1-3H3,(H,20,23)