diethyl-(2-hydroxyethyl)-methyl-azanium; 9H-xanthene-9-carboxylate; hydrochloride

Systemtic Name: diethyl-(2-hydroxyethyl)-methyl-azanium; 9H-xanthene-9-carboxylate; hydrochloride Openeye Name: diethyl-(2-hydroxyethyl)-methyl-ammonium; 9H-xanthene-9-carboxylate; hydrochloride CAS Name: diethyl-(2-hydroxyethyl)-methylammonium; 9H-xanthene-9-carboxylate; hydrochloride IUPAC Name: diethyl-(2-hydroxyethyl)-methylazanium; 9H-xanthene-9-carboxylate; hydrochloride Traditional Name: diethyl-(2-hydroxyethyl)-methyl-ammonium; 9H-xanthene-9-carboxylate; hydrochloride Formula: C21H28ClNO4 MolecularWeight: 393.90432

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Descriptors Computed from Structure

Canonical SMILES:

CC[N+](C)(CC)CCO.C1=CC=C2C(=C1)C(C3=CC=CC=C3O2)C(=O)[O-].Cl

Isomeric SMILES

CC[N+](C)(CC)CCO.C1=CC=C2C(=C1)C(C3=CC=CC=C3O2)C(=O)[O-].Cl

InChI

InChI=1S/C14H10O3.C7H18NO.ClH/c15-14(16)13-9-5-1-3-7-11(9)17-12-8-4-2-6-10(12)13;1-4-8(3,5-2)6-7-9;/h1-8,13H,(H,15,16);9H,4-7H2,1-3H3;1H/q;+1;/p-1