2-[2-acetyloxyethyl(methyl)amino]ethyl 4-azanyl-3-bromanyl-5-(diethylaminomethyl)benzoate

Systemtic Name: 2-[2-acetyloxyethyl(methyl)amino]ethyl 4-azanyl-3-bromanyl-5-(diethylaminomethyl)benzoate Openeye Name: 2-[2-acetoxyethyl(methyl)amino]ethyl 4-amino-3-bromo-5-(diethylaminomethyl)benzoate CAS Name: 4-amino-3-bromo-5-(diethylaminomethyl)benzoic acid 2-[2-acetyloxyethyl(methyl)amino]ethyl ester IUPAC Name: 2-[2-acetyloxyethyl(methyl)amino]ethyl 4-amino-3-bromo-5-(diethylaminomethyl)benzoate Traditional Name: 4-amino-3-bromo-5-(diethylaminomethyl)benzoic acid 2-[2-acetoxyethyl(methyl)amino]ethyl ester Formula: C19H30BrN3O4 MolecularWeight: 444.3632

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CC1=C(C(=CC(=C1)C(=O)OCCN(C)CCOC(=O)C)Br)N

Isomeric SMILES

CCN(CC)CC1=C(C(=CC(=C1)C(=O)OCCN(C)CCOC(=O)C)Br)N

InChI

InChI=1S/C19H30BrN3O4/c1-5-23(6-2)13-16-11-15(12-17(20)18(16)21)19(25)27-10-8-22(4)7-9-26-14(3)24/h11-12H,5-10,13,21H2,1-4H3