2-diethylaminoethyl 4-[(2-octoxyphenyl)carbonylamino]benzoate

Systemtic Name: 2-diethylaminoethyl 4-[(2-octoxyphenyl)carbonylamino]benzoate Openeye Name: 2-diethylaminoethyl 4-[(2-octoxybenzoyl)amino]benzoate CAS Name: 4-[[(2-octoxyphenyl)-oxomethyl]amino]benzoic acid 2-diethylaminoethyl ester IUPAC Name: 2-diethylaminoethyl 4-[(2-octoxybenzoyl)amino]benzoate Traditional Name: 4-[(2-octoxybenzoyl)amino]benzoic acid 2-diethylaminoethyl ester Formula: C28H40N2O4 MolecularWeight: 468.6282

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCOC1=CC=CC=C1C(=O)NC2=CC=C(C=C2)C(=O)OCCN(CC)CC

Isomeric SMILES

CCCCCCCCOC1=CC=CC=C1C(=O)NC2=CC=C(C=C2)C(=O)OCCN(CC)CC

InChI

InChI=1S/C28H40N2O4/c1-4-7-8-9-10-13-21-33-26-15-12-11-14-25(26)27(31)29-24-18-16-23(17-19-24)28(32)34-22-20-30(5-2)6-3/h11-12,14-19H,4-10,13,20-22H2,1-3H3,(H,29,31)