ethyl 4-acetamido-3-bromanyl-5-(diethylaminomethyl)benzoate hydrochloride

Systemtic Name: ethyl 4-acetamido-3-bromanyl-5-(diethylaminomethyl)benzoate hydrochloride Openeye Name: ethyl 4-acetamido-3-bromo-5-(diethylaminomethyl)benzoate hydrochloride CAS Name: 4-acetamido-3-bromo-5-(diethylaminomethyl)benzoic acid ethyl ester hydrochloride IUPAC Name: ethyl 4-acetamido-3-bromo-5-(diethylaminomethyl)benzoate hydrochloride Traditional Name: 4-acetamido-3-bromo-5-(diethylaminomethyl)benzoic acid ethyl ester hydrochloride Formula: C16H24BrClN2O3 MolecularWeight: 407.73036

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CC1=C(C(=CC(=C1)C(=O)OCC)Br)NC(=O)C.Cl

Isomeric SMILES

CCN(CC)CC1=C(C(=CC(=C1)C(=O)OCC)Br)NC(=O)C.Cl

InChI

InChI=1S/C16H23BrN2O3.ClH/c1-5-19(6-2)10-13-8-12(16(21)22-7-3)9-14(17)15(13)18-11(4)20;/h8-9H,5-7,10H2,1-4H3,(H,18,20);1H