2-diethylaminoethyl 4-(2-benzamidoethanoylamino)benzoate hydrochloride

Systemtic Name: 2-diethylaminoethyl 4-(2-benzamidoethanoylamino)benzoate hydrochloride Openeye Name: 2-diethylaminoethyl 4-[(2-benzamidoacetyl)amino]benzoate hydrochloride CAS Name: 4-[(2-benzamido-1-oxoethyl)amino]benzoic acid 2-diethylaminoethyl ester hydrochloride IUPAC Name: 2-diethylaminoethyl 4-[(2-benzamidoacetyl)amino]benzoate hydrochloride Traditional Name: 4-(hippuroylamino)benzoic acid 2-diethylaminoethyl ester hydrochloride Formula: C22H28ClN3O4 MolecularWeight: 433.92842

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CCOC(=O)C1=CC=C(C=C1)NC(=O)CNC(=O)C2=CC=CC=C2.Cl

Isomeric SMILES

CCN(CC)CCOC(=O)C1=CC=C(C=C1)NC(=O)CNC(=O)C2=CC=CC=C2.Cl

InChI

InChI=1S/C22H27N3O4.ClH/c1-3-25(4-2)14-15-29-22(28)18-10-12-19(13-11-18)24-20(26)16-23-21(27)17-8-6-5-7-9-17;/h5-13H,3-4,14-16H2,1-2H3,(H,23,27)(H,24,26);1H