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

Systemtic Name: methyl 2-[3-(4-tert-butylphenoxy)propylamino]-3-methyl-benzoate Openeye Name: methyl 2-[3-(4-tert-butylphenoxy)propylamino]-3-methyl-benzoate CAS Name: 2-[3-(4-tert-butylphenoxy)propylamino]-3-methylbenzoic acid methyl ester IUPAC Name: methyl 2-[3-(4-tert-butylphenoxy)propylamino]-3-methylbenzoate Traditional Name: 2-[3-(4-tert-butylphenoxy)propylamino]-3-methyl-benzoic acid methyl ester Formula: C22H29NO3 MolecularWeight: 355.47056

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1NCCCOC2=CC=C(C=C2)C(C)(C)C)C(=O)OC

Isomeric SMILES

CC1=CC=CC(=C1NCCCOC2=CC=C(C=C2)C(C)(C)C)C(=O)OC

InChI

InChI=1S/C22H29NO3/c1-16-8-6-9-19(21(24)25-5)20(16)23-14-7-15-26-18-12-10-17(11-13-18)22(2,3)4/h6,8-13,23H,7,14-15H2,1-5H3