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

Systemtic Name: 2-chloroethyl 4-azanyl-3-bromanyl-5-(piperidin-1-ylmethyl)benzoate Openeye Name: 2-chloroethyl 4-amino-3-bromo-5-(1-piperidylmethyl)benzoate CAS Name: 4-amino-3-bromo-5-(1-piperidinylmethyl)benzoic acid 2-chloroethyl ester IUPAC Name: 2-chloroethyl 4-amino-3-bromo-5-(piperidin-1-ylmethyl)benzoate Traditional Name: 4-amino-3-bromo-5-(piperidinomethyl)benzoic acid 2-chloroethyl ester Formula: C15H20BrClN2O2 MolecularWeight: 375.6885

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)CC2=C(C(=CC(=C2)C(=O)OCCCl)Br)N

Isomeric SMILES

C1CCN(CC1)CC2=C(C(=CC(=C2)C(=O)OCCCl)Br)N

InChI

InChI=1S/C15H20BrClN2O2/c16-13-9-11(15(20)21-7-4-17)8-12(14(13)18)10-19-5-2-1-3-6-19/h8-9H,1-7,10,18H2