2-acetyloxyethyl 4-azanyl-3-bromanyl-5-(piperidin-1-ylmethyl)benzoate

Systemtic Name: 2-acetyloxyethyl 4-azanyl-3-bromanyl-5-(piperidin-1-ylmethyl)benzoate Openeye Name: 2-acetoxyethyl 4-amino-3-bromo-5-(1-piperidylmethyl)benzoate CAS Name: 4-amino-3-bromo-5-(1-piperidinylmethyl)benzoic acid 2-acetyloxyethyl ester IUPAC Name: 2-acetyloxyethyl 4-amino-3-bromo-5-(piperidin-1-ylmethyl)benzoate Traditional Name: 4-amino-3-bromo-5-(piperidinomethyl)benzoic acid 2-acetoxyethyl ester Formula: C17H23BrN2O4 MolecularWeight: 399.27952

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OCCOC(=O)C1=CC(=C(C(=C1)Br)N)CN2CCCCC2

Isomeric SMILES

CC(=O)OCCOC(=O)C1=CC(=C(C(=C1)Br)N)CN2CCCCC2

InChI

InChI=1S/C17H23BrN2O4/c1-12(21)23-7-8-24-17(22)13-9-14(16(19)15(18)10-13)11-20-5-3-2-4-6-20/h9-10H,2-8,11,19H2,1H3