methyl 2-[[3-(2,4-dimethyl-6-phosphonooxy-phenyl)-3-methyl-butanoyl]amino]ethanoate

Systemtic Name: methyl 2-[[3-(2,4-dimethyl-6-phosphonooxy-phenyl)-3-methyl-butanoyl]amino]ethanoate Openeye Name: methyl 2-[[3-(2,4-dimethyl-6-phosphonooxy-phenyl)-3-methyl-butanoyl]amino]acetate CAS Name: 2-[[3-(2,4-dimethyl-6-phosphonooxyphenyl)-3-methyl-1-oxobutyl]amino]acetic acid methyl ester IUPAC Name: methyl 2-[[3-(2,4-dimethyl-6-phosphonooxyphenyl)-3-methylbutanoyl]amino]acetate Traditional Name: 2-[[3-(2,4-dimethyl-6-phosphonooxy-phenyl)-3-methyl-butanoyl]amino]acetic acid methyl ester Formula: C16H24NO7P MolecularWeight: 373.338021

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)OP(=O)(O)O)C(C)(C)CC(=O)NCC(=O)OC)C

Isomeric SMILES

CC1=CC(=C(C(=C1)OP(=O)(O)O)C(C)(C)CC(=O)NCC(=O)OC)C

InChI

InChI=1S/C16H24NO7P/c1-10-6-11(2)15(12(7-10)24-25(20,21)22)16(3,4)8-13(18)17-9-14(19)23-5/h6-7H,8-9H2,1-5H3,(H,17,18)(H2,20,21,22)