[2-[(4-methylphenyl)methylamino]-2-oxidanylidene-ethyl] 4-butoxybenzoate

Systemtic Name: [2-[(4-methylphenyl)methylamino]-2-oxidanylidene-ethyl] 4-butoxybenzoate Openeye Name: [2-oxo-2-(p-tolylmethylamino)ethyl] 4-butoxybenzoate CAS Name: 4-butoxybenzoic acid [2-[(4-methylphenyl)methylamino]-2-oxoethyl] ester IUPAC Name: [2-[(4-methylphenyl)methylamino]-2-oxoethyl] 4-butoxybenzoate Traditional Name: 4-butoxybenzoic acid [2-keto-2-[(4-methylbenzyl)amino]ethyl] ester Formula: C21H25NO4 MolecularWeight: 355.4275

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)C(=O)OCC(=O)NCC2=CC=C(C=C2)C

Isomeric SMILES

CCCCOC1=CC=C(C=C1)C(=O)OCC(=O)NCC2=CC=C(C=C2)C

InChI

InChI=1S/C21H25NO4/c1-3-4-13-25-19-11-9-18(10-12-19)21(24)26-15-20(23)22-14-17-7-5-16(2)6-8-17/h5-12H,3-4,13-15H2,1-2H3,(H,22,23)