methyl 2-[(2-azanyl-2-oxidanylidene-ethyl)amino]-3-bromanyl-5-methyl-benzoate

Systemtic Name: methyl 2-[(2-azanyl-2-oxidanylidene-ethyl)amino]-3-bromanyl-5-methyl-benzoate Openeye Name: methyl 2-[(2-amino-2-oxo-ethyl)amino]-3-bromo-5-methyl-benzoate CAS Name: 2-[(2-amino-2-oxoethyl)amino]-3-bromo-5-methylbenzoic acid methyl ester IUPAC Name: methyl 2-[(2-amino-2-oxoethyl)amino]-3-bromo-5-methylbenzoate Traditional Name: 2-[(2-amino-2-keto-ethyl)amino]-3-bromo-5-methyl-benzoic acid methyl ester Formula: C11H13BrN2O3 MolecularWeight: 301.13652

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)C(=O)OC)NCC(=O)N)Br

Isomeric SMILES

CC1=CC(=C(C(=C1)C(=O)OC)NCC(=O)N)Br

InChI

InChI=1S/C11H13BrN2O3/c1-6-3-7(11(16)17-2)10(8(12)4-6)14-5-9(13)15/h3-4,14H,5H2,1-2H3,(H2,13,15)