4-[[5,7-bis(azanyl)pyrido[3,4-b]pyrazin-3-yl]methyl-methyl-amino]benzoic acid

Systemtic Name: 4-[[5,7-bis(azanyl)pyrido[3,4-b]pyrazin-3-yl]methyl-methyl-amino]benzoic acid Openeye Name: 4-[(5,7-diaminopyrido[3,4-b]pyrazin-3-yl)methyl-methyl-amino]benzoic acid CAS Name: 4-[(5,7-diamino-3-pyrido[3,4-b]pyrazinyl)methyl-methylamino]benzoic acid IUPAC Name: 4-[(5,7-diaminopyrido[3,4-b]pyrazin-3-yl)methyl-methylamino]benzoic acid Traditional Name: 4-[(5,7-diaminopyrido[3,4-b]pyrazin-3-yl)methyl-methyl-amino]benzoic acid Formula: C16H16N6O2 MolecularWeight: 324.33724

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=NC2=C(N=C(C=C2N=C1)N)N)C3=CC=C(C=C3)C(=O)O

Isomeric SMILES

CN(CC1=NC2=C(N=C(C=C2N=C1)N)N)C3=CC=C(C=C3)C(=O)O

InChI

InChI=1S/C16H16N6O2/c1-22(11-4-2-9(3-5-11)16(23)24)8-10-7-19-12-6-13(17)21-15(18)14(12)20-10/h2-7H,8H2,1H3,(H,23,24)(H4,17,18,21)