ethyl 2-[2-[(3,5-dimethylphenyl)methoxy]ethanoyl-ethyl-amino]-6-(hexylamino)benzoate

Systemtic Name: ethyl 2-[2-[(3,5-dimethylphenyl)methoxy]ethanoyl-ethyl-amino]-6-(hexylamino)benzoate Openeye Name: ethyl 2-[[2-[(3,5-dimethylphenyl)methoxy]acetyl]-ethyl-amino]-6-(hexylamino)benzoate CAS Name: 2-[[2-[(3,5-dimethylphenyl)methoxy]-1-oxoethyl]-ethylamino]-6-(hexylamino)benzoic acid ethyl ester IUPAC Name: ethyl 2-[[2-[(3,5-dimethylphenyl)methoxy]acetyl]-ethylamino]-6-(hexylamino)benzoate Traditional Name: 2-[[2-(3,5-dimethylbenzyl)oxyacetyl]-ethyl-amino]-6-(hexylamino)benzoic acid ethyl ester Formula: C28H40N2O4 MolecularWeight: 468.6282

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCNC1=C(C(=CC=C1)N(CC)C(=O)COCC2=CC(=CC(=C2)C)C)C(=O)OCC

Isomeric SMILES

CCCCCCNC1=C(C(=CC=C1)N(CC)C(=O)COCC2=CC(=CC(=C2)C)C)C(=O)OCC

InChI

InChI=1S/C28H40N2O4/c1-6-9-10-11-15-29-24-13-12-14-25(27(24)28(32)34-8-3)30(7-2)26(31)20-33-19-23-17-21(4)16-22(5)18-23/h12-14,16-18,29H,6-11,15,19-20H2,1-5H3