4-(2-azanyl-2-oxidanylidene-ethyl)-2-[(3,4-dichlorophenyl)methyl]-1,3-bis(oxidanylidene)pyrrolo[1,2-a]pyrazine-4-carboxylic acid

Systemtic Name: 4-(2-azanyl-2-oxidanylidene-ethyl)-2-[(3,4-dichlorophenyl)methyl]-1,3-bis(oxidanylidene)pyrrolo[1,2-a]pyrazine-4-carboxylic acid Openeye Name: 4-(2-amino-2-oxo-ethyl)-2-[(3,4-dichlorophenyl)methyl]-1,3-dioxo-pyrrolo[1,2-a]pyrazine-4-carboxylic acid CAS Name: 4-(2-amino-2-oxoethyl)-2-[(3,4-dichlorophenyl)methyl]-1,3-dioxo-4-pyrrolo[1,2-a]pyrazinecarboxylic acid IUPAC Name: 4-(2-amino-2-oxoethyl)-2-[(3,4-dichlorophenyl)methyl]-1,3-dioxopyrrolo[1,2-a]pyrazine-4-carboxylic acid Traditional Name: 4-(2-amino-2-keto-ethyl)-2-(3,4-dichlorobenzyl)-1,3-diketo-pyrrolo[1,2-a]pyrazine-4-carboxylic acid Formula: C17H13Cl2N3O5 MolecularWeight: 410.20822

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CN2C(=C1)C(=O)N(C(=O)C2(CC(=O)N)C(=O)O)CC3=CC(=C(C=C3)Cl)Cl

Isomeric SMILES

C1=CN2C(=C1)C(=O)N(C(=O)C2(CC(=O)N)C(=O)O)CC3=CC(=C(C=C3)Cl)Cl

InChI

InChI=1S/C17H13Cl2N3O5/c18-10-4-3-9(6-11(10)19)8-21-14(24)12-2-1-5-22(12)17(15(21)25,16(26)27)7-13(20)23/h1-6H,7-8H2,(H2,20,23)(H,26,27)