[2-[(4-dimethylaminophenyl)amino]-2-oxidanylidene-ethyl] 4-butoxybenzoate

Systemtic Name: [2-[(4-dimethylaminophenyl)amino]-2-oxidanylidene-ethyl] 4-butoxybenzoate Openeye Name: [2-[4-(dimethylamino)anilino]-2-oxo-ethyl] 4-butoxybenzoate CAS Name: 4-butoxybenzoic acid [2-[4-(dimethylamino)anilino]-2-oxoethyl] ester IUPAC Name: [2-[4-(dimethylamino)anilino]-2-oxoethyl] 4-butoxybenzoate Traditional Name: 4-butoxybenzoic acid [2-[4-(dimethylamino)anilino]-2-keto-ethyl] ester Formula: C21H26N2O4 MolecularWeight: 370.44214

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)C(=O)OCC(=O)NC2=CC=C(C=C2)N(C)C

Isomeric SMILES

CCCCOC1=CC=C(C=C1)C(=O)OCC(=O)NC2=CC=C(C=C2)N(C)C

InChI

InChI=1S/C21H26N2O4/c1-4-5-14-26-19-12-6-16(7-13-19)21(25)27-15-20(24)22-17-8-10-18(11-9-17)23(2)3/h6-13H,4-5,14-15H2,1-3H3,(H,22,24)