ethyl 3-bromanyl-4-(heptan-2-ylamino)benzoate

Systemtic Name: ethyl 3-bromanyl-4-(heptan-2-ylamino)benzoate Openeye Name: ethyl 3-bromo-4-(1-methylhexylamino)benzoate CAS Name: 3-bromo-4-(heptan-2-ylamino)benzoic acid ethyl ester IUPAC Name: ethyl 3-bromo-4-(heptan-2-ylamino)benzoate Traditional Name: 3-bromo-4-(1-methylhexylamino)benzoic acid ethyl ester Formula: C16H24BrNO2 MolecularWeight: 342.27126

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(C)NC1=C(C=C(C=C1)C(=O)OCC)Br

Isomeric SMILES

CCCCCC(C)NC1=C(C=C(C=C1)C(=O)OCC)Br

InChI

InChI=1S/C16H24BrNO2/c1-4-6-7-8-12(3)18-15-10-9-13(11-14(15)17)16(19)20-5-2/h9-12,18H,4-8H2,1-3H3