(phenylmethyl) 4-bromanyl-2-(butylamino)benzoate

Systemtic Name: (phenylmethyl) 4-bromanyl-2-(butylamino)benzoate Openeye Name: benzyl 4-bromo-2-(butylamino)benzoate CAS Name: 4-bromo-2-(butylamino)benzoic acid (phenylmethyl) ester IUPAC Name: benzyl 4-bromo-2-(butylamino)benzoate Traditional Name: 4-bromo-2-(butylamino)benzoic acid benzyl ester Formula: C18H20BrNO2 MolecularWeight: 362.2609

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC1=C(C=CC(=C1)Br)C(=O)OCC2=CC=CC=C2

Isomeric SMILES

CCCCNC1=C(C=CC(=C1)Br)C(=O)OCC2=CC=CC=C2

InChI

InChI=1S/C18H20BrNO2/c1-2-3-11-20-17-12-15(19)9-10-16(17)18(21)22-13-14-7-5-4-6-8-14/h4-10,12,20H,2-3,11,13H2,1H3