4-chloranylbutyl 4-azanyl-3-bromanyl-5-[(propan-2-ylamino)methyl]benzoate

Systemtic Name: 4-chloranylbutyl 4-azanyl-3-bromanyl-5-[(propan-2-ylamino)methyl]benzoate Openeye Name: 4-chlorobutyl 4-amino-3-bromo-5-[(isopropylamino)methyl]benzoate CAS Name: 4-amino-3-bromo-5-[(propan-2-ylamino)methyl]benzoic acid 4-chlorobutyl ester IUPAC Name: 4-chlorobutyl 4-amino-3-bromo-5-[(propan-2-ylamino)methyl]benzoate Traditional Name: 4-amino-3-bromo-5-[(isopropylamino)methyl]benzoic acid 4-chlorobutyl ester Formula: C15H22BrClN2O2 MolecularWeight: 377.70438

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H22BrClN2O2/c1-10(2)19-9-12-7-11(8-13(16)14(12)18)15(20)21-6-4-3-5-17/h7-8,10,19H,3-6,9,18H2,1-2H3