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

Systemtic Name: methyl 2-[2-(4-tert-butylphenoxy)ethylamino]-3-methyl-benzoate Openeye Name: methyl 2-[2-(4-tert-butylphenoxy)ethylamino]-3-methyl-benzoate CAS Name: 2-[2-(4-tert-butylphenoxy)ethylamino]-3-methylbenzoic acid methyl ester IUPAC Name: methyl 2-[2-(4-tert-butylphenoxy)ethylamino]-3-methylbenzoate Traditional Name: 2-[2-(4-tert-butylphenoxy)ethylamino]-3-methyl-benzoic acid methyl ester Formula: C21H27NO3 MolecularWeight: 341.44398

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1NCCOC2=CC=C(C=C2)C(C)(C)C)C(=O)OC

Isomeric SMILES

CC1=CC=CC(=C1NCCOC2=CC=C(C=C2)C(C)(C)C)C(=O)OC

InChI

InChI=1S/C21H27NO3/c1-15-7-6-8-18(20(23)24-5)19(15)22-13-14-25-17-11-9-16(10-12-17)21(2,3)4/h6-12,22H,13-14H2,1-5H3