ethyl 4-[(2-azanyl-4-methyl-pentanoyl)amino]-3-bromanyl-benzoate

Systemtic Name: ethyl 4-[(2-azanyl-4-methyl-pentanoyl)amino]-3-bromanyl-benzoate Openeye Name: ethyl 4-[(2-amino-4-methyl-pentanoyl)amino]-3-bromo-benzoate CAS Name: 4-[(2-amino-4-methyl-1-oxopentyl)amino]-3-bromobenzoic acid ethyl ester IUPAC Name: ethyl 4-[(2-amino-4-methylpentanoyl)amino]-3-bromobenzoate Traditional Name: 4-[(2-amino-4-methyl-pentanoyl)amino]-3-bromo-benzoic acid ethyl ester Formula: C15H21BrN2O3 MolecularWeight: 357.24284

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC(=C(C=C1)NC(=O)C(CC(C)C)N)Br

Isomeric SMILES

CCOC(=O)C1=CC(=C(C=C1)NC(=O)C(CC(C)C)N)Br

InChI

InChI=1S/C15H21BrN2O3/c1-4-21-15(20)10-5-6-13(11(16)8-10)18-14(19)12(17)7-9(2)3/h5-6,8-9,12H,4,7,17H2,1-3H3,(H,18,19)