[4-oxidanylidene-3-(phenylmethyl)-7,8-dihydro-6H-pyrrolo[1,2-a]pyrazin-1-yl] benzoate

Systemtic Name: [4-oxidanylidene-3-(phenylmethyl)-7,8-dihydro-6H-pyrrolo[1,2-a]pyrazin-1-yl] benzoate Openeye Name: (3-benzyl-4-oxo-7,8-dihydro-6H-pyrrolo[1,2-a]pyrazin-1-yl) benzoate CAS Name: benzoic acid [4-oxo-3-(phenylmethyl)-7,8-dihydro-6H-pyrrolo[1,2-a]pyrazin-1-yl] ester IUPAC Name: (3-benzyl-4-oxo-7,8-dihydro-6H-pyrrolo[1,2-a]pyrazin-1-yl) benzoate Traditional Name: benzoic acid (3-benzyl-4-keto-7,8-dihydro-6H-pyrrolo[1,2-a]pyrazin-1-yl) ester Formula: C21H18N2O3 MolecularWeight: 346.37922

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2=C(N=C(C(=O)N2C1)CC3=CC=CC=C3)OC(=O)C4=CC=CC=C4

Isomeric SMILES

C1CC2=C(N=C(C(=O)N2C1)CC3=CC=CC=C3)OC(=O)C4=CC=CC=C4

InChI

InChI=1S/C21H18N2O3/c24-20-17(14-15-8-3-1-4-9-15)22-19(18-12-7-13-23(18)20)26-21(25)16-10-5-2-6-11-16/h1-6,8-11H,7,12-14H2