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

Systemtic Name: 2-hydroxyethyl 4-azanyl-3-bromanyl-5-[(tert-butylamino)methyl]benzoate Openeye Name: 2-hydroxyethyl 4-amino-3-bromo-5-[(tert-butylamino)methyl]benzoate CAS Name: 4-amino-3-bromo-5-[(tert-butylamino)methyl]benzoic acid 2-hydroxyethyl ester IUPAC Name: 2-hydroxyethyl 4-amino-3-bromo-5-[(tert-butylamino)methyl]benzoate Traditional Name: 4-amino-3-bromo-5-[(tert-butylamino)methyl]benzoic acid 2-hydroxyethyl ester Formula: C14H21BrN2O3 MolecularWeight: 345.23214

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H21BrN2O3/c1-14(2,3)17-8-10-6-9(7-11(15)12(10)16)13(19)20-5-4-18/h6-7,17-18H,4-5,8,16H2,1-3H3