2-diethylaminoethyl 4-nitronaphthalene-1-carboxylate hydrochloride

Systemtic Name: 2-diethylaminoethyl 4-nitronaphthalene-1-carboxylate hydrochloride Openeye Name: 2-diethylaminoethyl 4-nitronaphthalene-1-carboxylate hydrochloride CAS Name: 4-nitro-1-naphthalenecarboxylic acid 2-diethylaminoethyl ester hydrochloride IUPAC Name: 2-diethylaminoethyl 4-nitronaphthalene-1-carboxylate hydrochloride Traditional Name: 4-nitronaphthalene-1-carboxylic acid 2-diethylaminoethyl ester hydrochloride Formula: C17H21ClN2O4 MolecularWeight: 352.81264

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CCOC(=O)C1=CC=C(C2=CC=CC=C21)[N+](=O)[O-].Cl

Isomeric SMILES

CCN(CC)CCOC(=O)C1=CC=C(C2=CC=CC=C21)[N+](=O)[O-].Cl

InChI

InChI=1S/C17H20N2O4.ClH/c1-3-18(4-2)11-12-23-17(20)15-9-10-16(19(21)22)14-8-6-5-7-13(14)15;/h5-10H,3-4,11-12H2,1-2H3;1H