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

Systemtic Name: methyl 2-[3-(4-tert-butylphenoxy)propylamino]-3-chloranyl-benzoate Openeye Name: methyl 2-[3-(4-tert-butylphenoxy)propylamino]-3-chloro-benzoate CAS Name: 2-[3-(4-tert-butylphenoxy)propylamino]-3-chlorobenzoic acid methyl ester IUPAC Name: methyl 2-[3-(4-tert-butylphenoxy)propylamino]-3-chlorobenzoate Traditional Name: 2-[3-(4-tert-butylphenoxy)propylamino]-3-chloro-benzoic acid methyl ester Formula: C21H26ClNO3 MolecularWeight: 375.88904

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)OCCCNC2=C(C=CC=C2Cl)C(=O)OC

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)OCCCNC2=C(C=CC=C2Cl)C(=O)OC

InChI

InChI=1S/C21H26ClNO3/c1-21(2,3)15-9-11-16(12-10-15)26-14-6-13-23-19-17(20(24)25-4)7-5-8-18(19)22/h5,7-12,23H,6,13-14H2,1-4H3