4-methylpentyl 2-[(3-bromophenyl)carbonylamino]propanoate

Systemtic Name: 4-methylpentyl 2-[(3-bromophenyl)carbonylamino]propanoate Openeye Name: isohexyl 2-[(3-bromobenzoyl)amino]propanoate CAS Name: 2-[[(3-bromophenyl)-oxomethyl]amino]propanoic acid 4-methylpentyl ester IUPAC Name: 4-methylpentyl 2-[(3-bromobenzoyl)amino]propanoate Traditional Name: 2-[(3-bromobenzoyl)amino]propionic acid isohexyl ester Formula: C16H22BrNO3 MolecularWeight: 356.25478

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCCOC(=O)C(C)NC(=O)C1=CC(=CC=C1)Br

Isomeric SMILES

CC(C)CCCOC(=O)C(C)NC(=O)C1=CC(=CC=C1)Br

InChI

InChI=1S/C16H22BrNO3/c1-11(2)6-5-9-21-16(20)12(3)18-15(19)13-7-4-8-14(17)10-13/h4,7-8,10-12H,5-6,9H2,1-3H3,(H,18,19)