(6S)-4-oxidanylidene-3-(phenethylamino)-7,8-dihydro-6H-pyrrolo[1,2-a]pyrazine-6-carboxylic acid

Systemtic Name: (6S)-4-oxidanylidene-3-(phenethylamino)-7,8-dihydro-6H-pyrrolo[1,2-a]pyrazine-6-carboxylic acid Openeye Name: (6S)-4-oxo-3-(phenethylamino)-7,8-dihydro-6H-pyrrolo[1,2-a]pyrazine-6-carboxylic acid CAS Name: (6S)-4-oxo-3-(phenethylamino)-7,8-dihydro-6H-pyrrolo[1,2-a]pyrazine-6-carboxylic acid IUPAC Name: (6S)-4-oxo-3-(phenethylamino)-7,8-dihydro-6H-pyrrolo[1,2-a]pyrazine-6-carboxylic acid Traditional Name: (6S)-4-keto-3-(phenethylamino)-7,8-dihydro-6H-pyrrolo[1,2-a]pyrazine-6-carboxylic acid Formula: C16H17N3O3 MolecularWeight: 299.32448

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2=CN=C(C(=O)N2C1C(=O)O)NCCC3=CC=CC=C3

Isomeric SMILES

C1CC2=CN=C(C(=O)N2[C@@H]1C(=O)O)NCCC3=CC=CC=C3

InChI

InChI=1S/C16H17N3O3/c20-15-14(17-9-8-11-4-2-1-3-5-11)18-10-12-6-7-13(16(21)22)19(12)15/h1-5,10,13H,6-9H2,(H,17,18)(H,21,22)/t13-/m0/s1