2-[(6-azanyl-3,6-dihydropurin-9-yl)methyl]butanedioic acid

Systemtic Name: 2-[(6-azanyl-3,6-dihydropurin-9-yl)methyl]butanedioic acid Openeye Name: 2-[(6-amino-3,6-dihydropurin-9-yl)methyl]butanedioic acid CAS Name: 2-[(6-amino-3,6-dihydropurin-9-yl)methyl]butanedioic acid IUPAC Name: 2-[(6-amino-3,6-dihydropurin-9-yl)methyl]butanedioic acid Traditional Name: 2-[(6-amino-3,6-dihydropurin-9-yl)methyl]succinic acid Formula: C10H13N5O4 MolecularWeight: 267.24132

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Descriptors Computed from Structure

Canonical SMILES:

C1=NC(C2=C(N1)N(C=N2)CC(CC(=O)O)C(=O)O)N

Isomeric SMILES

C1=NC(C2=C(N1)N(C=N2)CC(CC(=O)O)C(=O)O)N

InChI

InChI=1S/C10H13N5O4/c11-8-7-9(13-3-12-8)15(4-14-7)2-5(10(18)19)1-6(16)17/h3-5,8H,1-2,11H2,(H,12,13)(H,16,17)(H,18,19)