diethylazanium; (2S)-2-[(triphenylmethyl)amino]pentanedioate

Systemtic Name: diethylazanium; (2S)-2-[(triphenylmethyl)amino]pentanedioate Openeye Name: diethylammonium; (2S)-2-(tritylamino)pentanedioate CAS Name: diethylammonium; (2S)-2-[(triphenylmethyl)amino]pentanedioate IUPAC Name: diethylazanium; (2S)-2-(tritylamino)pentanedioate Traditional Name: diethylammonium; (2S)-2-(tritylamino)glutarate Formula: C32H45N3O4 MolecularWeight: 535.7174

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH2+]CC.CC[NH2+]CC.C1=CC=C(C=C1)C(C2=CC=CC=C2)(C3=CC=CC=C3)NC(CCC(=O)[O-])C(=O)[O-]

Isomeric SMILES

CC[NH2+]CC.CC[NH2+]CC.C1=CC=C(C=C1)C(C2=CC=CC=C2)(C3=CC=CC=C3)N[C@@H](CCC(=O)[O-])C(=O)[O-]

InChI

InChI=1S/C24H23NO4.2C4H11N/c26-22(27)17-16-21(23(28)29)25-24(18-10-4-1-5-11-18,19-12-6-2-7-13-19)20-14-8-3-9-15-20;2*1-3-5-4-2/h1-15,21,25H,16-17H2,(H,26,27)(H,28,29);2*5H,3-4H2,1-2H3/t21-;;/m0../s1