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

Systemtic Name: 3-[1-(3-methylphenyl)-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazin-2-yl]-3-oxidanylidene-propanoic acid Openeye Name: 3-[1-(m-tolyl)-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazin-2-yl]-3-oxo-propanoic acid CAS Name: 3-[1-(3-methylphenyl)-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazin-2-yl]-3-oxopropanoic acid IUPAC Name: 3-[1-(3-methylphenyl)-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazin-2-yl]-3-oxopropanoic acid Traditional Name: 3-keto-3-[1-(m-tolyl)-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazin-2-yl]propionic acid Formula: C17H18N2O3 MolecularWeight: 298.33642

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C2C3=CC=CN3CCN2C(=O)CC(=O)O

Isomeric SMILES

CC1=CC=CC(=C1)C2C3=CC=CN3CCN2C(=O)CC(=O)O

InChI

InChI=1S/C17H18N2O3/c1-12-4-2-5-13(10-12)17-14-6-3-7-18(14)8-9-19(17)15(20)11-16(21)22/h2-7,10,17H,8-9,11H2,1H3,(H,21,22)