2-azanyl-9-(2-hydroxyethyloxymethyl)-3H-purin-6-one; 2-morpholin-4-ylethyl (E)-6-(6-methoxy-7-methyl-4-oxidanyl-3-oxidanylidene-1H-2-benzofuran-5-yl)-4-methyl-hex-4-enoate

Systemtic Name: 2-azanyl-9-(2-hydroxyethyloxymethyl)-3H-purin-6-one; 2-morpholin-4-ylethyl (E)-6-(6-methoxy-7-methyl-4-oxidanyl-3-oxidanylidene-1H-2-benzofuran-5-yl)-4-methyl-hex-4-enoate Openeye Name: 2-amino-9-(2-hydroxyethoxymethyl)-3H-purin-6-one; 2-morpholinoethyl (E)-6-(4-hydroxy-6-methoxy-7-methyl-3-oxo-1H-isobenzofuran-5-yl)-4-methyl-hex-4-enoate CAS Name: 2-amino-9-(2-hydroxyethoxymethyl)-3H-purin-6-one; (E)-6-(4-hydroxy-6-methoxy-7-methyl-3-oxo-1H-isobenzofuran-5-yl)-4-methyl-4-hexenoic acid 2-(4-morpholinyl)ethyl ester IUPAC Name: 2-amino-9-(2-hydroxyethoxymethyl)-3H-purin-6-one; 2-morpholin-4-ylethyl (E)-6-(4-hydroxy-6-methoxy-7-methyl-3-oxo-1H-2-benzofuran-5-yl)-4-methylhex-4-enoate Traditional Name: 2-amino-9-(2-hydroxyethoxymethyl)-3H-purin-6-one; (E)-6-(4-hydroxy-3-keto-6-methoxy-7-methyl-phthalan-5-yl)-4-methyl-hex-4-enoic acid 2-morpholinoethyl ester Formula: C31H42N6O10 MolecularWeight: 658.69938

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(C2=C1COC2=O)O)CC=C(C)CCC(=O)OCCN3CCOCC3)OC.C1=NC2=C(N1COCCO)NC(=NC2=O)N

Isomeric SMILES

CC1=C(C(=C(C2=C1COC2=O)O)C/C=C(\C)/CCC(=O)OCCN3CCOCC3)OC.C1=NC2=C(N1COCCO)NC(=NC2=O)N

InChI

InChI=1S/C23H31NO7.C8H11N5O3/c1-15(5-7-19(25)30-13-10-24-8-11-29-12-9-24)4-6-17-21(26)20-18(14-31-23(20)27)16(2)22(17)28-3;9-8-11-6-5(7(15)12-8)10-3-13(6)4-16-2-1-14/h4,26H,5-14H2,1-3H3;3,14H,1-2,4H2,(H3,9,11,12,15)/b15-4+;