2-(2-azanylethyl)-7-(phenylmethyl)-3H-purin-6-one hydrochloride

Systemtic Name: 2-(2-azanylethyl)-7-(phenylmethyl)-3H-purin-6-one hydrochloride Openeye Name: 2-(2-aminoethyl)-7-benzyl-3H-purin-6-one hydrochloride CAS Name: 2-(2-aminoethyl)-7-(phenylmethyl)-3H-purin-6-one hydrochloride IUPAC Name: 2-(2-aminoethyl)-7-benzyl-3H-purin-6-one hydrochloride Traditional Name: 2-(2-aminoethyl)-7-benzyl-3H-purin-6-one hydrochloride Formula: C14H16ClN5O MolecularWeight: 305.76274

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN2C=NC3=C2C(=O)N=C(N3)CCN.Cl

Isomeric SMILES

C1=CC=C(C=C1)CN2C=NC3=C2C(=O)N=C(N3)CCN.Cl

InChI

InChI=1S/C14H15N5O.ClH/c15-7-6-11-17-13-12(14(20)18-11)19(9-16-13)8-10-4-2-1-3-5-10;/h1-5,9H,6-8,15H2,(H,17,18,20);1H