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

Systemtic Name: methyl 2-[4-(4-tert-butylphenoxy)butylamino]-3-methyl-benzoate Openeye Name: methyl 2-[4-(4-tert-butylphenoxy)butylamino]-3-methyl-benzoate CAS Name: 2-[4-(4-tert-butylphenoxy)butylamino]-3-methylbenzoic acid methyl ester IUPAC Name: methyl 2-[4-(4-tert-butylphenoxy)butylamino]-3-methylbenzoate Traditional Name: 2-[4-(4-tert-butylphenoxy)butylamino]-3-methyl-benzoic acid methyl ester Formula: C23H31NO3 MolecularWeight: 369.49714

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1NCCCCOC2=CC=C(C=C2)C(C)(C)C)C(=O)OC

Isomeric SMILES

CC1=CC=CC(=C1NCCCCOC2=CC=C(C=C2)C(C)(C)C)C(=O)OC

InChI

InChI=1S/C23H31NO3/c1-17-9-8-10-20(22(25)26-5)21(17)24-15-6-7-16-27-19-13-11-18(12-14-19)23(2,3)4/h8-14,24H,6-7,15-16H2,1-5H3