cyanomethyl (3aR)-4-cyclopropyl-1,5-bis(oxidanylidene)-2,3-dihydropyrrolo[1,2-a]quinazoline-3a-carboxylate

Systemtic Name: cyanomethyl (3aR)-4-cyclopropyl-1,5-bis(oxidanylidene)-2,3-dihydropyrrolo[1,2-a]quinazoline-3a-carboxylate Openeye Name: cyanomethyl (3aR)-4-cyclopropyl-1,5-dioxo-2,3-dihydropyrrolo[1,2-a]quinazoline-3a-carboxylate CAS Name: (3aR)-4-cyclopropyl-1,5-dioxo-2,3-dihydropyrrolo[1,2-a]quinazoline-3a-carboxylic acid cyanomethyl ester IUPAC Name: cyanomethyl (3aR)-4-cyclopropyl-1,5-dioxo-2,3-dihydropyrrolo[1,2-a]quinazoline-3a-carboxylate Traditional Name: (3aR)-4-cyclopropyl-1,5-diketo-2,3-dihydropyrrolo[1,2-a]quinazoline-3a-carboxylic acid cyanomethyl ester Formula: C17H15N3O4 MolecularWeight: 325.3187

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1N2C(=O)C3=CC=CC=C3N4C2(CCC4=O)C(=O)OCC#N

Isomeric SMILES

C1CC1N2C(=O)C3=CC=CC=C3N4[C@]2(CCC4=O)C(=O)OCC#N

InChI

InChI=1S/C17H15N3O4/c18-9-10-24-16(23)17-8-7-14(21)20(17)13-4-2-1-3-12(13)15(22)19(17)11-5-6-11/h1-4,11H,5-8,10H2/t17-/m1/s1