(phenylmethyl) 4-(2-diethylaminoethylamino)-3-[2-(4-ethoxyphenyl)ethanoylamino]benzoate

Systemtic Name: (phenylmethyl) 4-(2-diethylaminoethylamino)-3-[2-(4-ethoxyphenyl)ethanoylamino]benzoate Openeye Name: benzyl 4-(2-diethylaminoethylamino)-3-[[2-(4-ethoxyphenyl)acetyl]amino]benzoate CAS Name: 4-(2-diethylaminoethylamino)-3-[[2-(4-ethoxyphenyl)-1-oxoethyl]amino]benzoic acid (phenylmethyl) ester IUPAC Name: benzyl 4-(2-diethylaminoethylamino)-3-[[2-(4-ethoxyphenyl)acetyl]amino]benzoate Traditional Name: 4-(2-diethylaminoethylamino)-3-[(2-p-phenetylacetyl)amino]benzoic acid benzyl ester Formula: C30H37N3O4 MolecularWeight: 503.63248

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CCNC1=C(C=C(C=C1)C(=O)OCC2=CC=CC=C2)NC(=O)CC3=CC=C(C=C3)OCC

Isomeric SMILES

CCN(CC)CCNC1=C(C=C(C=C1)C(=O)OCC2=CC=CC=C2)NC(=O)CC3=CC=C(C=C3)OCC

InChI

InChI=1S/C30H37N3O4/c1-4-33(5-2)19-18-31-27-17-14-25(30(35)37-22-24-10-8-7-9-11-24)21-28(27)32-29(34)20-23-12-15-26(16-13-23)36-6-3/h7-17,21,31H,4-6,18-20,22H2,1-3H3,(H,32,34)