methyl 4-azanyl-3-bromanyl-5-(diethylaminomethyl)benzoate

Systemtic Name: methyl 4-azanyl-3-bromanyl-5-(diethylaminomethyl)benzoate Openeye Name: methyl 4-amino-3-bromo-5-(diethylaminomethyl)benzoate CAS Name: 4-amino-3-bromo-5-(diethylaminomethyl)benzoic acid methyl ester IUPAC Name: methyl 4-amino-3-bromo-5-(diethylaminomethyl)benzoate Traditional Name: 4-amino-3-bromo-5-(diethylaminomethyl)benzoic acid methyl ester Formula: C13H19BrN2O2 MolecularWeight: 315.20616

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H19BrN2O2/c1-4-16(5-2)8-10-6-9(13(17)18-3)7-11(14)12(10)15/h6-7H,4-5,8,15H2,1-3H3