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

Systemtic Name: 2-[2-acetyloxyethyl(ethyl)amino]ethyl 4-azanyl-3-bromanyl-5-(diethylaminomethyl)benzoate Openeye Name: 2-[2-acetoxyethyl(ethyl)amino]ethyl 4-amino-3-bromo-5-(diethylaminomethyl)benzoate CAS Name: 4-amino-3-bromo-5-(diethylaminomethyl)benzoic acid 2-[2-acetyloxyethyl(ethyl)amino]ethyl ester IUPAC Name: 2-[2-acetyloxyethyl(ethyl)amino]ethyl 4-amino-3-bromo-5-(diethylaminomethyl)benzoate Traditional Name: 4-amino-3-bromo-5-(diethylaminomethyl)benzoic acid 2-[2-acetoxyethyl(ethyl)amino]ethyl ester Formula: C20H32BrN3O4 MolecularWeight: 458.38978

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H32BrN3O4/c1-5-23(6-2)14-17-12-16(13-18(21)19(17)22)20(26)28-11-9-24(7-3)8-10-27-15(4)25/h12-13H,5-11,14,22H2,1-4H3