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6-chloranylhexyl 4-azanyl-3-bromanyl-5-(diethylaminomethyl)benzoate

6-chloranylhexyl 4-azanyl-3-bromanyl-5-(diethylaminomethyl)benzoate

Systemtic Name:6-chloranylhexyl 4-azanyl-3-bromanyl-5-(diethylaminomethyl)benzoate
Openeye Name:6-chlorohexyl 4-amino-3-bromo-5-(diethylaminomethyl)benzoate
CAS Name:4-amino-3-bromo-5-(diethylaminomethyl)benzoic acid 6-chlorohexyl ester
IUPAC Name:6-chlorohexyl 4-amino-3-bromo-5-(diethylaminomethyl)benzoate
Traditional Name:4-amino-3-bromo-5-(diethylaminomethyl)benzoic acid 6-chlorohexyl ester
Formula: C18H28BrClN2O2
MolecularWeight: 419.78412
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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CC1=C(C(=CC(=C1)C(=O)OCCCCCCCl)Br)N


Isomeric SMILES

CCN(CC)CC1=C(C(=CC(=C1)C(=O)OCCCCCCCl)Br)N


InChI

InChI=1S/C18H28BrClN2O2/c1-3-22(4-2)13-15-11-14(12-16(19)17(15)21)18(23)24-10-8-6-5-7-9-20/h11-12H,3-10,13,21H2,1-2H3


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