methyl (2R)-2-[2-[2-[(3-bromophenyl)amino]-2-oxidanylidene-ethoxy]ethanoylamino]-4-methyl-pentanoate

Systemtic Name: methyl (2R)-2-[2-[2-[(3-bromophenyl)amino]-2-oxidanylidene-ethoxy]ethanoylamino]-4-methyl-pentanoate Openeye Name: methyl (2R)-2-[[2-[2-(3-bromoanilino)-2-oxo-ethoxy]acetyl]amino]-4-methyl-pentanoate CAS Name: (2R)-2-[[2-[2-(3-bromoanilino)-2-oxoethoxy]-1-oxoethyl]amino]-4-methylpentanoic acid methyl ester IUPAC Name: methyl (2R)-2-[[2-[2-(3-bromoanilino)-2-oxoethoxy]acetyl]amino]-4-methylpentanoate Traditional Name: (2R)-2-[[2-[2-(3-bromoanilino)-2-keto-ethoxy]acetyl]amino]-4-methyl-valeric acid methyl ester Formula: C17H23BrN2O5 MolecularWeight: 415.27892

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)OC)NC(=O)COCC(=O)NC1=CC(=CC=C1)Br

Isomeric SMILES

CC(C)C[C@H](C(=O)OC)NC(=O)COCC(=O)NC1=CC(=CC=C1)Br

InChI

InChI=1S/C17H23BrN2O5/c1-11(2)7-14(17(23)24-3)20-16(22)10-25-9-15(21)19-13-6-4-5-12(18)8-13/h4-6,8,11,14H,7,9-10H2,1-3H3,(H,19,21)(H,20,22)/t14-/m1/s1