methyl (2S)-2-[[(2R)-3-(4-hydroxyphenyl)-2-methyl-propanoyl]amino]-4-methyl-pentanoate

Systemtic Name: methyl (2S)-2-[[(2R)-3-(4-hydroxyphenyl)-2-methyl-propanoyl]amino]-4-methyl-pentanoate Openeye Name: methyl (2S)-2-[[(2R)-3-(4-hydroxyphenyl)-2-methyl-propanoyl]amino]-4-methyl-pentanoate CAS Name: (2S)-2-[[(2R)-3-(4-hydroxyphenyl)-2-methyl-1-oxopropyl]amino]-4-methylpentanoic acid methyl ester IUPAC Name: methyl (2S)-2-[[(2R)-3-(4-hydroxyphenyl)-2-methylpropanoyl]amino]-4-methylpentanoate Traditional Name: (2S)-2-[[(2R)-3-(4-hydroxyphenyl)-2-methyl-propanoyl]amino]-4-methyl-valeric acid methyl ester Formula: C17H25NO4 MolecularWeight: 307.3847

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)OC)NC(=O)C(C)CC1=CC=C(C=C1)O

Isomeric SMILES

C[C@H](CC1=CC=C(C=C1)O)C(=O)N[C@@H](CC(C)C)C(=O)OC

InChI

InChI=1S/C17H25NO4/c1-11(2)9-15(17(21)22-4)18-16(20)12(3)10-13-5-7-14(19)8-6-13/h5-8,11-12,15,19H,9-10H2,1-4H3,(H,18,20)/t12-,15+/m1/s1