[4-[2-(ethylamino)ethyl]-2-(4-methylphenyl)carbonyloxy-phenyl] 4-methylbenzoate

Systemtic Name: [4-[2-(ethylamino)ethyl]-2-(4-methylphenyl)carbonyloxy-phenyl] 4-methylbenzoate Openeye Name: [4-[2-(ethylamino)ethyl]-2-(4-methylbenzoyl)oxy-phenyl] 4-methylbenzoate CAS Name: 4-methylbenzoic acid [4-[2-(ethylamino)ethyl]-2-[(4-methylphenyl)-oxomethoxy]phenyl] ester IUPAC Name: [4-[2-(ethylamino)ethyl]-2-(4-methylbenzoyl)oxyphenyl] 4-methylbenzoate Traditional Name: 4-methylbenzoic acid [4-[2-(ethylamino)ethyl]-2-p-toluoyloxy-phenyl] ester Formula: C26H27NO4 MolecularWeight: 417.49688

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Descriptors Computed from Structure

Canonical SMILES:

CCNCCC1=CC(=C(C=C1)OC(=O)C2=CC=C(C=C2)C)OC(=O)C3=CC=C(C=C3)C

Isomeric SMILES

CCNCCC1=CC(=C(C=C1)OC(=O)C2=CC=C(C=C2)C)OC(=O)C3=CC=C(C=C3)C

InChI

InChI=1S/C26H27NO4/c1-4-27-16-15-20-9-14-23(30-25(28)21-10-5-18(2)6-11-21)24(17-20)31-26(29)22-12-7-19(3)8-13-22/h5-14,17,27H,4,15-16H2,1-3H3