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2-chloroethyl 4-azanyl-3-bromanyl-5-[(tert-butylamino)methyl]benzoate

2-chloroethyl 4-azanyl-3-bromanyl-5-[(tert-butylamino)methyl]benzoate

Systemtic Name:2-chloroethyl 4-azanyl-3-bromanyl-5-[(tert-butylamino)methyl]benzoate
Openeye Name:2-chloroethyl 4-amino-3-bromo-5-[(tert-butylamino)methyl]benzoate
CAS Name:4-amino-3-bromo-5-[(tert-butylamino)methyl]benzoic acid 2-chloroethyl ester
IUPAC Name:2-chloroethyl 4-amino-3-bromo-5-[(tert-butylamino)methyl]benzoate
Traditional Name:4-amino-3-bromo-5-[(tert-butylamino)methyl]benzoic acid 2-chloroethyl ester
Formula: C14H20BrClN2O2
MolecularWeight: 363.6778
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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NCC1=C(C(=CC(=C1)C(=O)OCCCl)Br)N


Isomeric SMILES

CC(C)(C)NCC1=C(C(=CC(=C1)C(=O)OCCCl)Br)N


InChI

InChI=1S/C14H20BrClN2O2/c1-14(2,3)18-8-10-6-9(7-11(15)12(10)17)13(19)20-5-4-16/h6-7,18H,4-5,8,17H2,1-3H3


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