2-(2-acetyloxyphenyl)carbonyloxyethyl 4-azanyl-3-bromanyl-5-(diethylaminomethyl)benzoate

Systemtic Name: 2-(2-acetyloxyphenyl)carbonyloxyethyl 4-azanyl-3-bromanyl-5-(diethylaminomethyl)benzoate Openeye Name: 2-(2-acetoxybenzoyl)oxyethyl 4-amino-3-bromo-5-(diethylaminomethyl)benzoate CAS Name: 4-amino-3-bromo-5-(diethylaminomethyl)benzoic acid 2-[(2-acetyloxyphenyl)-oxomethoxy]ethyl ester IUPAC Name: 2-(2-acetyloxybenzoyl)oxyethyl 4-amino-3-bromo-5-(diethylaminomethyl)benzoate Traditional Name: 4-amino-3-bromo-5-(diethylaminomethyl)benzoic acid 2-(2-acetoxybenzoyl)oxyethyl ester Formula: C23H27BrN2O6 MolecularWeight: 507.37428

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CC1=C(C(=CC(=C1)C(=O)OCCOC(=O)C2=CC=CC=C2OC(=O)C)Br)N

Isomeric SMILES

CCN(CC)CC1=C(C(=CC(=C1)C(=O)OCCOC(=O)C2=CC=CC=C2OC(=O)C)Br)N

InChI

InChI=1S/C23H27BrN2O6/c1-4-26(5-2)14-17-12-16(13-19(24)21(17)25)22(28)30-10-11-31-23(29)18-8-6-7-9-20(18)32-15(3)27/h6-9,12-13H,4-5,10-11,14,25H2,1-3H3