2-[[(4-methoxyphenyl)-diphenyl-methyl]amino]-2-(6-oxidanylidene-3H-purin-9-yl)ethanoic acid

Systemtic Name: 2-[[(4-methoxyphenyl)-diphenyl-methyl]amino]-2-(6-oxidanylidene-3H-purin-9-yl)ethanoic acid Openeye Name: 2-[[(4-methoxyphenyl)-diphenyl-methyl]amino]-2-(6-oxo-3H-purin-9-yl)acetic acid CAS Name: 2-[[(4-methoxyphenyl)-diphenylmethyl]amino]-2-(6-oxo-3H-purin-9-yl)acetic acid IUPAC Name: 2-[[(4-methoxyphenyl)-diphenylmethyl]amino]-2-(6-oxo-3H-purin-9-yl)acetic acid Traditional Name: 2-(6-keto-3H-purin-9-yl)-2-[[(4-methoxyphenyl)-diphenyl-methyl]amino]acetic acid Formula: C27H23N5O4 MolecularWeight: 481.50262

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C(C2=CC=CC=C2)(C3=CC=CC=C3)NC(C(=O)O)N4C=NC5=C4NC=NC5=O

Isomeric SMILES

COC1=CC=C(C=C1)C(C2=CC=CC=C2)(C3=CC=CC=C3)NC(C(=O)O)N4C=NC5=C4NC=NC5=O

InChI

InChI=1S/C27H23N5O4/c1-36-21-14-12-20(13-15-21)27(18-8-4-2-5-9-18,19-10-6-3-7-11-19)31-24(26(34)35)32-17-30-22-23(32)28-16-29-25(22)33/h2-17,24,31H,1H3,(H,34,35)(H,28,29,33)