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

Systemtic Name: 5-chloranylpentyl 4-azanyl-3-bromanyl-5-(piperidin-1-ylmethyl)benzoate Openeye Name: 5-chloropentyl 4-amino-3-bromo-5-(1-piperidylmethyl)benzoate CAS Name: 4-amino-3-bromo-5-(1-piperidinylmethyl)benzoic acid 5-chloropentyl ester IUPAC Name: 5-chloropentyl 4-amino-3-bromo-5-(piperidin-1-ylmethyl)benzoate Traditional Name: 4-amino-3-bromo-5-(piperidinomethyl)benzoic acid 5-chloropentyl ester Formula: C18H26BrClN2O2 MolecularWeight: 417.76824

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H26BrClN2O2/c19-16-12-14(18(23)24-10-6-1-3-7-20)11-15(17(16)21)13-22-8-4-2-5-9-22/h11-12H,1-10,13,21H2