2-diethylaminoethyl 2-[(2,4-dimethylphenyl)-phenyl-amino]benzoate chloride

Systemtic Name: 2-diethylaminoethyl 2-[(2,4-dimethylphenyl)-phenyl-amino]benzoate chloride Openeye Name: 2-diethylaminoethyl 2-(N-(2,4-dimethylphenyl)anilino)benzoate chloride CAS Name: 2-(N-(2,4-dimethylphenyl)anilino)benzoic acid 2-diethylaminoethyl ester chloride IUPAC Name: 2-diethylaminoethyl 2-(N-(2,4-dimethylphenyl)anilino)benzoate chloride Traditional Name: 2-(N-(2,4-dimethylphenyl)anilino)benzoic acid 2-diethylaminoethyl ester chloride Formula: C27H32ClN2O2- MolecularWeight: 452.00818

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CCOC(=O)C1=CC=CC=C1N(C2=CC=CC=C2)C3=C(C=C(C=C3)C)C.[Cl-]

Isomeric SMILES

CCN(CC)CCOC(=O)C1=CC=CC=C1N(C2=CC=CC=C2)C3=C(C=C(C=C3)C)C.[Cl-]

InChI

InChI=1S/C27H32N2O2.ClH/c1-5-28(6-2)18-19-31-27(30)24-14-10-11-15-26(24)29(23-12-8-7-9-13-23)25-17-16-21(3)20-22(25)4;/h7-17,20H,5-6,18-19H2,1-4H3;1H/p-1