[(1S,4R)-4-(6-aminopurin-9-yl)cyclopent-2-en-1-yl]methyl N-(2-hydroxyphenyl)carbonylsulfamate

Systemtic Name: [(1S,4R)-4-(6-aminopurin-9-yl)cyclopent-2-en-1-yl]methyl N-(2-hydroxyphenyl)carbonylsulfamate Openeye Name: [(1S,4R)-4-(6-aminopurin-9-yl)cyclopent-2-en-1-yl]methyl N-(2-hydroxybenzoyl)sulfamate CAS Name: N-[(2-hydroxyphenyl)-oxomethyl]sulfamic acid [(1S,4R)-4-(6-aminopurin-9-yl)-1-cyclopent-2-enyl]methyl ester IUPAC Name: [(1S,4R)-4-(6-aminopurin-9-yl)cyclopent-2-en-1-yl]methyl N-(2-hydroxybenzoyl)sulfamate Traditional Name: N-salicyloylsulfamic acid [(1S,4R)-4-adenin-9-ylcyclopent-2-en-1-yl]methyl ester Formula: C18H18N6O5S MolecularWeight: 430.43772

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Descriptors Computed from Structure

Canonical SMILES:

C1C(C=CC1N2C=NC3=C2N=CN=C3N)COS(=O)(=O)NC(=O)C4=CC=CC=C4O

Isomeric SMILES

C1[C@@H](C=C[C@@H]1N2C=NC3=C2N=CN=C3N)COS(=O)(=O)NC(=O)C4=CC=CC=C4O

InChI

InChI=1S/C18H18N6O5S/c19-16-15-17(21-9-20-16)24(10-22-15)12-6-5-11(7-12)8-29-30(27,28)23-18(26)13-3-1-2-4-14(13)25/h1-6,9-12,25H,7-8H2,(H,23,26)(H2,19,20,21)/t11-,12+/m1/s1