methyl 2-(7H-purin-8-ylamino)-2-(1,2,3,4-tetrahydronaphthalen-2-yl)ethanoate

Systemtic Name: methyl 2-(7H-purin-8-ylamino)-2-(1,2,3,4-tetrahydronaphthalen-2-yl)ethanoate Openeye Name: methyl 2-(7H-purin-8-ylamino)-2-tetralin-2-yl-acetate CAS Name: 2-(7H-purin-8-ylamino)-2-(1,2,3,4-tetrahydronaphthalen-2-yl)acetic acid methyl ester IUPAC Name: methyl 2-(7H-purin-8-ylamino)-2-(1,2,3,4-tetrahydronaphthalen-2-yl)acetate Traditional Name: 2-(7H-purin-8-ylamino)-2-tetralin-2-yl-acetic acid methyl ester Formula: C18H19N5O2 MolecularWeight: 337.37576

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(C1CCC2=CC=CC=C2C1)NC3=NC4=NC=NC=C4N3

Isomeric SMILES

COC(=O)C(C1CCC2=CC=CC=C2C1)NC3=NC4=NC=NC=C4N3

InChI

InChI=1S/C18H19N5O2/c1-25-17(24)15(13-7-6-11-4-2-3-5-12(11)8-13)22-18-21-14-9-19-10-20-16(14)23-18/h2-5,9-10,13,15H,6-8H2,1H3,(H2,19,20,21,22,23)