methyl 2-[4-(4-tert-butylphenoxy)butylamino]-3-chloranyl-benzoate

Systemtic Name: methyl 2-[4-(4-tert-butylphenoxy)butylamino]-3-chloranyl-benzoate Openeye Name: methyl 2-[4-(4-tert-butylphenoxy)butylamino]-3-chloro-benzoate CAS Name: 2-[4-(4-tert-butylphenoxy)butylamino]-3-chlorobenzoic acid methyl ester IUPAC Name: methyl 2-[4-(4-tert-butylphenoxy)butylamino]-3-chlorobenzoate Traditional Name: 2-[4-(4-tert-butylphenoxy)butylamino]-3-chloro-benzoic acid methyl ester Formula: C22H28ClNO3 MolecularWeight: 389.91562

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)OCCCCNC2=C(C=CC=C2Cl)C(=O)OC

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)OCCCCNC2=C(C=CC=C2Cl)C(=O)OC

InChI

InChI=1S/C22H28ClNO3/c1-22(2,3)16-10-12-17(13-11-16)27-15-6-5-14-24-20-18(21(25)26-4)8-7-9-19(20)23/h7-13,24H,5-6,14-15H2,1-4H3