methyl 3-[[(2R)-2-[(4-bromophenyl)carbonylamino]-3-methyl-butanoyl]amino]propanoate

Systemtic Name: methyl 3-[[(2R)-2-[(4-bromophenyl)carbonylamino]-3-methyl-butanoyl]amino]propanoate Openeye Name: methyl 3-[[(2R)-2-[(4-bromobenzoyl)amino]-3-methyl-butanoyl]amino]propanoate CAS Name: 3-[[(2R)-2-[[(4-bromophenyl)-oxomethyl]amino]-3-methyl-1-oxobutyl]amino]propanoic acid methyl ester IUPAC Name: methyl 3-[[(2R)-2-[(4-bromobenzoyl)amino]-3-methylbutanoyl]amino]propanoate Traditional Name: 3-[[(2R)-2-[(4-bromobenzoyl)amino]-3-methyl-butanoyl]amino]propionic acid methyl ester Formula: C16H21BrN2O4 MolecularWeight: 385.25294

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)NCCC(=O)OC)NC(=O)C1=CC=C(C=C1)Br

Isomeric SMILES

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

InChI

InChI=1S/C16H21BrN2O4/c1-10(2)14(16(22)18-9-8-13(20)23-3)19-15(21)11-4-6-12(17)7-5-11/h4-7,10,14H,8-9H2,1-3H3,(H,18,22)(H,19,21)/t14-/m1/s1