4-[(1S)-1-(4-methylphenyl)-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazin-2-yl]-4-oxidanylidene-butanoate

Systemtic Name: 4-[(1S)-1-(4-methylphenyl)-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazin-2-yl]-4-oxidanylidene-butanoate Openeye Name: 4-oxo-4-[(1S)-1-(p-tolyl)-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazin-2-yl]butanoate CAS Name: 4-[(1S)-1-(4-methylphenyl)-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazin-2-yl]-4-oxobutanoate IUPAC Name: 4-[(1S)-1-(4-methylphenyl)-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazin-2-yl]-4-oxobutanoate Traditional Name: 4-keto-4-[(1S)-1-(p-tolyl)-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazin-2-yl]butyrate Formula: C18H19N2O3- MolecularWeight: 311.35506

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2C3=CC=CN3CCN2C(=O)CCC(=O)[O-]

Isomeric SMILES

CC1=CC=C(C=C1)[C@H]2C3=CC=CN3CCN2C(=O)CCC(=O)[O-]

InChI

InChI=1S/C18H20N2O3/c1-13-4-6-14(7-5-13)18-15-3-2-10-19(15)11-12-20(18)16(21)8-9-17(22)23/h2-7,10,18H,8-9,11-12H2,1H3,(H,22,23)/p-1/t18-/m0/s1