methyl 5-methyl-2-(4-phenoxybutylamino)benzoate

Systemtic Name: methyl 5-methyl-2-(4-phenoxybutylamino)benzoate Openeye Name: methyl 5-methyl-2-(4-phenoxybutylamino)benzoate CAS Name: 5-methyl-2-(4-phenoxybutylamino)benzoic acid methyl ester IUPAC Name: methyl 5-methyl-2-(4-phenoxybutylamino)benzoate Traditional Name: 5-methyl-2-(4-phenoxybutylamino)benzoic acid methyl ester Formula: C19H23NO3 MolecularWeight: 313.39082

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)NCCCCOC2=CC=CC=C2)C(=O)OC

Isomeric SMILES

CC1=CC(=C(C=C1)NCCCCOC2=CC=CC=C2)C(=O)OC

InChI

InChI=1S/C19H23NO3/c1-15-10-11-18(17(14-15)19(21)22-2)20-12-6-7-13-23-16-8-4-3-5-9-16/h3-5,8-11,14,20H,6-7,12-13H2,1-2H3