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2-[1,3-dimethyl-2,6-bis(oxidanylidene)purin-7-yl]ethanoic acid; (1R,2S)-2-(methylamino)-1-phenyl-propan-1-ol

2-[1,3-dimethyl-2,6-bis(oxidanylidene)purin-7-yl]ethanoic acid; (1R,2S)-2-(methylamino)-1-phenyl-propan-1-ol

Systemtic Name:2-[1,3-dimethyl-2,6-bis(oxidanylidene)purin-7-yl]ethanoic acid; (1R,2S)-2-(methylamino)-1-phenyl-propan-1-ol
Openeye Name:2-(1,3-dimethyl-2,6-dioxo-purin-7-yl)acetic acid; (1R,2S)-2-(methylamino)-1-phenyl-propan-1-ol
CAS Name:2-(1,3-dimethyl-2,6-dioxo-7-purinyl)acetic acid; (1R,2S)-2-(methylamino)-1-phenyl-1-propanol
IUPAC Name:2-(1,3-dimethyl-2,6-dioxopurin-7-yl)acetic acid; (1R,2S)-2-(methylamino)-1-phenylpropan-1-ol
Traditional Name:2-(2,6-diketo-1,3-dimethyl-purin-7-yl)acetic acid; (1R,2S)-2-(methylamino)-1-phenyl-propan-1-ol
Formula: C19H25N5O5
MolecularWeight: 403.4323
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Descriptors Computed from Structure

Canonical SMILES:

CC(C(C1=CC=CC=C1)O)NC.CN1C2=C(C(=O)N(C1=O)C)N(C=N2)CC(=O)O


Isomeric SMILES

C[C@@H]([C@@H](C1=CC=CC=C1)O)NC.CN1C2=C(C(=O)N(C1=O)C)N(C=N2)CC(=O)O


InChI

InChI=1S/C10H15NO.C9H10N4O4/c1-8(11-2)10(12)9-6-4-3-5-7-9;1-11-7-6(8(16)12(2)9(11)17)13(4-10-7)3-5(14)15/h3-8,10-12H,1-2H3;4H,3H2,1-2H3,(H,14,15)/t8-,10-;/m0./s1


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