2-[2-[bis(phenylmethyl)amino]propanoylamino]pentanedioate hydrochloride

Systemtic Name: 2-[2-[bis(phenylmethyl)amino]propanoylamino]pentanedioate hydrochloride Openeye Name: 2-[2-(dibenzylamino)propanoylamino]pentanedioate hydrochloride CAS Name: 2-[[2-[bis(phenylmethyl)amino]-1-oxopropyl]amino]pentanedioate hydrochloride IUPAC Name: 2-[2-(dibenzylamino)propanoylamino]pentanedioate hydrochloride Traditional Name: 2-[2-(dibenzylamino)propanoylamino]glutarate hydrochloride Formula: C22H25ClN2O5-2 MolecularWeight: 432.8973

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC(CCC(=O)[O-])C(=O)[O-])N(CC1=CC=CC=C1)CC2=CC=CC=C2.Cl

Isomeric SMILES

CC(C(=O)NC(CCC(=O)[O-])C(=O)[O-])N(CC1=CC=CC=C1)CC2=CC=CC=C2.Cl

InChI

InChI=1S/C22H26N2O5.ClH/c1-16(21(27)23-19(22(28)29)12-13-20(25)26)24(14-17-8-4-2-5-9-17)15-18-10-6-3-7-11-18;/h2-11,16,19H,12-15H2,1H3,(H,23,27)(H,25,26)(H,28,29);1H/p-2