methyl 4-[3-(dimethylamino)-4-octan-2-yloxy-phenyl]benzoate

Systemtic Name: methyl 4-[3-(dimethylamino)-4-octan-2-yloxy-phenyl]benzoate Openeye Name: methyl 4-[3-(dimethylamino)-4-(1-methylheptoxy)phenyl]benzoate CAS Name: 4-[3-(dimethylamino)-4-octan-2-yloxyphenyl]benzoic acid methyl ester IUPAC Name: methyl 4-[3-(dimethylamino)-4-octan-2-yloxyphenyl]benzoate Traditional Name: 4-[3-(dimethylamino)-4-(1-methylheptoxy)phenyl]benzoic acid methyl ester Formula: C24H33NO3 MolecularWeight: 383.52372

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(C)OC1=C(C=C(C=C1)C2=CC=C(C=C2)C(=O)OC)N(C)C

Isomeric SMILES

CCCCCCC(C)OC1=C(C=C(C=C1)C2=CC=C(C=C2)C(=O)OC)N(C)C

InChI

InChI=1S/C24H33NO3/c1-6-7-8-9-10-18(2)28-23-16-15-21(17-22(23)25(3)4)19-11-13-20(14-12-19)24(26)27-5/h11-18H,6-10H2,1-5H3