methyl 2-[(4-bromanyl-2-methyl-phenyl)carbamoylamino]-3-methyl-butanoate

Systemtic Name: methyl 2-[(4-bromanyl-2-methyl-phenyl)carbamoylamino]-3-methyl-butanoate Openeye Name: methyl 2-[(4-bromo-2-methyl-phenyl)carbamoylamino]-3-methyl-butanoate CAS Name: 2-[[(4-bromo-2-methylanilino)-oxomethyl]amino]-3-methylbutanoic acid methyl ester IUPAC Name: methyl 2-[(4-bromo-2-methylphenyl)carbamoylamino]-3-methylbutanoate Traditional Name: 2-[(4-bromo-2-methyl-phenyl)carbamoylamino]-3-methyl-butyric acid methyl ester Formula: C14H19BrN2O3 MolecularWeight: 343.21626

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H19BrN2O3/c1-8(2)12(13(18)20-4)17-14(19)16-11-6-5-10(15)7-9(11)3/h5-8,12H,1-4H3,(H2,16,17,19)