ethyl (2S)-2-[[2-[(2-azanyl-6-oxidanylidene-3H-purin-9-yl)methoxy]ethoxy-naphthalen-1-yloxy-phosphoryl]amino]-3-methyl-butanoate

Systemtic Name: ethyl (2S)-2-[[2-[(2-azanyl-6-oxidanylidene-3H-purin-9-yl)methoxy]ethoxy-naphthalen-1-yloxy-phosphoryl]amino]-3-methyl-butanoate Openeye Name: ethyl (2S)-2-[[2-[(2-amino-6-oxo-3H-purin-9-yl)methoxy]ethoxy-(1-naphthyloxy)phosphoryl]amino]-3-methyl-butanoate CAS Name: (2S)-2-[[2-[(2-amino-6-oxo-3H-purin-9-yl)methoxy]ethoxy-(1-naphthalenyloxy)phosphoryl]amino]-3-methylbutanoic acid ethyl ester IUPAC Name: ethyl (2S)-2-[[2-[(2-amino-6-oxo-3H-purin-9-yl)methoxy]ethoxy-naphthalen-1-yloxyphosphoryl]amino]-3-methylbutanoate Traditional Name: (2S)-2-[[2-[(2-amino-6-keto-3H-purin-9-yl)methoxy]ethoxy-(1-naphthoxy)phosphoryl]amino]-3-methyl-butyric acid ethyl ester Formula: C25H31N6O7P MolecularWeight: 558.523401

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C(C)C)NP(=O)(OCCOCN1C=NC2=C1NC(=NC2=O)N)OC3=CC=CC4=CC=CC=C43

Isomeric SMILES

CCOC(=O)[C@H](C(C)C)NP(=O)(OCCOCN1C=NC2=C1NC(=NC2=O)N)OC3=CC=CC4=CC=CC=C43

InChI

InChI=1S/C25H31N6O7P/c1-4-36-24(33)20(16(2)3)30-39(34,38-19-11-7-9-17-8-5-6-10-18(17)19)37-13-12-35-15-31-14-27-21-22(31)28-25(26)29-23(21)32/h5-11,14,16,20H,4,12-13,15H2,1-3H3,(H,30,34)(H3,26,28,29,32)/t20-,39?/m0/s1