cyclohexylmethyl (3aS)-4-ethyl-1,5-bis(oxidanylidene)-2,3-dihydropyrrolo[1,2-a]quinazoline-3a-carboxylate

Systemtic Name: cyclohexylmethyl (3aS)-4-ethyl-1,5-bis(oxidanylidene)-2,3-dihydropyrrolo[1,2-a]quinazoline-3a-carboxylate Openeye Name: cyclohexylmethyl (3aS)-4-ethyl-1,5-dioxo-2,3-dihydropyrrolo[1,2-a]quinazoline-3a-carboxylate CAS Name: (3aS)-4-ethyl-1,5-dioxo-2,3-dihydropyrrolo[1,2-a]quinazoline-3a-carboxylic acid cyclohexylmethyl ester IUPAC Name: cyclohexylmethyl (3aS)-4-ethyl-1,5-dioxo-2,3-dihydropyrrolo[1,2-a]quinazoline-3a-carboxylate Traditional Name: (3aS)-4-ethyl-1,5-diketo-2,3-dihydropyrrolo[1,2-a]quinazoline-3a-carboxylic acid cyclohexylmethyl ester Formula: C21H26N2O4 MolecularWeight: 370.44214

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=O)C2=CC=CC=C2N3C1(CCC3=O)C(=O)OCC4CCCCC4

Isomeric SMILES

CCN1C(=O)C2=CC=CC=C2N3[C@@]1(CCC3=O)C(=O)OCC4CCCCC4

InChI

InChI=1S/C21H26N2O4/c1-2-22-19(25)16-10-6-7-11-17(16)23-18(24)12-13-21(22,23)20(26)27-14-15-8-4-3-5-9-15/h6-7,10-11,15H,2-5,8-9,12-14H2,1H3/t21-/m0/s1