ethyl 2-(2-azanylethanoylamino)-3-(3-oxidanyl-4-phosphonooxy-phenyl)propanoate

Systemtic Name: ethyl 2-(2-azanylethanoylamino)-3-(3-oxidanyl-4-phosphonooxy-phenyl)propanoate Openeye Name: ethyl 2-[(2-aminoacetyl)amino]-3-(3-hydroxy-4-phosphonooxy-phenyl)propanoate CAS Name: 2-[(2-amino-1-oxoethyl)amino]-3-(3-hydroxy-4-phosphonooxyphenyl)propanoic acid ethyl ester IUPAC Name: ethyl 2-[(2-aminoacetyl)amino]-3-(3-hydroxy-4-phosphonooxyphenyl)propanoate Traditional Name: 2-(glycylamino)-3-(3-hydroxy-4-phosphonooxy-phenyl)propionic acid ethyl ester Formula: C13H19N2O8P MolecularWeight: 362.272321

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(CC1=CC(=C(C=C1)OP(=O)(O)O)O)NC(=O)CN

Isomeric SMILES

CCOC(=O)C(CC1=CC(=C(C=C1)OP(=O)(O)O)O)NC(=O)CN

InChI

InChI=1S/C13H19N2O8P/c1-2-22-13(18)9(15-12(17)7-14)5-8-3-4-11(10(16)6-8)23-24(19,20)21/h3-4,6,9,16H,2,5,7,14H2,1H3,(H,15,17)(H2,19,20,21)