2-methoxyethyl-[9-(4-nitrophenyl)purin-6-yl]carbamic acid

Systemtic Name: 2-methoxyethyl-[9-(4-nitrophenyl)purin-6-yl]carbamic acid Openeye Name: 2-methoxyethyl-[9-(4-nitrophenyl)purin-6-yl]carbamic acid CAS Name: 2-methoxyethyl-[9-(4-nitrophenyl)-6-purinyl]carbamic acid IUPAC Name: 2-methoxyethyl-[9-(4-nitrophenyl)purin-6-yl]carbamic acid Traditional Name: 2-methoxyethyl-[9-(4-nitrophenyl)purin-6-yl]carbamic acid Formula: C15H14N6O5 MolecularWeight: 358.30886

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Descriptors Computed from Structure

Canonical SMILES:

COCCN(C1=NC=NC2=C1N=CN2C3=CC=C(C=C3)[N+](=O)[O-])C(=O)O

Isomeric SMILES

COCCN(C1=NC=NC2=C1N=CN2C3=CC=C(C=C3)[N+](=O)[O-])C(=O)O

InChI

InChI=1S/C15H14N6O5/c1-26-7-6-19(15(22)23)13-12-14(17-8-16-13)20(9-18-12)10-2-4-11(5-3-10)21(24)25/h2-5,8-9H,6-7H2,1H3,(H,22,23)