methyl 5-bromanyl-2-(4-naphthalen-2-yloxybutylamino)benzoate

Systemtic Name: methyl 5-bromanyl-2-(4-naphthalen-2-yloxybutylamino)benzoate Openeye Name: methyl 5-bromo-2-[4-(2-naphthyloxy)butylamino]benzoate CAS Name: 5-bromo-2-[4-(2-naphthalenyloxy)butylamino]benzoic acid methyl ester IUPAC Name: methyl 5-bromo-2-(4-naphthalen-2-yloxybutylamino)benzoate Traditional Name: 5-bromo-2-[4-(2-naphthoxy)butylamino]benzoic acid methyl ester Formula: C22H22BrNO3 MolecularWeight: 428.31898

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(C=CC(=C1)Br)NCCCCOC2=CC3=CC=CC=C3C=C2

Isomeric SMILES

COC(=O)C1=C(C=CC(=C1)Br)NCCCCOC2=CC3=CC=CC=C3C=C2

InChI

InChI=1S/C22H22BrNO3/c1-26-22(25)20-15-18(23)9-11-21(20)24-12-4-5-13-27-19-10-8-16-6-2-3-7-17(16)14-19/h2-3,6-11,14-15,24H,4-5,12-13H2,1H3