2-[[7-chloranyl-2,3-bis(oxidanylidene)-1,4-dihydroquinoxalin-5-yl]methylamino]benzoic acid

Systemtic Name: 2-[[7-chloranyl-2,3-bis(oxidanylidene)-1,4-dihydroquinoxalin-5-yl]methylamino]benzoic acid Openeye Name: 2-[(7-chloro-2,3-dioxo-1,4-dihydroquinoxalin-5-yl)methylamino]benzoic acid CAS Name: 2-[(7-chloro-2,3-dioxo-1,4-dihydroquinoxalin-5-yl)methylamino]benzoic acid IUPAC Name: 2-[(7-chloro-2,3-dioxo-1,4-dihydroquinoxalin-5-yl)methylamino]benzoic acid Traditional Name: 2-[(7-chloro-2,3-diketo-1,4-dihydroquinoxalin-5-yl)methylamino]benzoic acid Formula: C16H12ClN3O4 MolecularWeight: 345.73718

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C(=O)O)NCC2=CC(=CC3=C2NC(=O)C(=O)N3)Cl

Isomeric SMILES

C1=CC=C(C(=C1)C(=O)O)NCC2=CC(=CC3=C2NC(=O)C(=O)N3)Cl

InChI

InChI=1S/C16H12ClN3O4/c17-9-5-8(13-12(6-9)19-14(21)15(22)20-13)7-18-11-4-2-1-3-10(11)16(23)24/h1-6,18H,7H2,(H,19,21)(H,20,22)(H,23,24)