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3-azanyl-1-(2-diethylaminoethyl)-2-propyl-cyclohexa-3,5-diene-1,2-dicarboxylic acid hydrochloride

3-azanyl-1-(2-diethylaminoethyl)-2-propyl-cyclohexa-3,5-diene-1,2-dicarboxylic acid hydrochloride

Systemtic Name:3-azanyl-1-(2-diethylaminoethyl)-2-propyl-cyclohexa-3,5-diene-1,2-dicarboxylic acid hydrochloride
Openeye Name:3-amino-1-(2-diethylaminoethyl)-2-propyl-cyclohexa-3,5-diene-1,2-dicarboxylic acid hydrochloride
CAS Name:3-amino-1-(2-diethylaminoethyl)-2-propylcyclohexa-3,5-diene-1,2-dicarboxylic acid hydrochloride
IUPAC Name:3-amino-1-(2-diethylaminoethyl)-2-propylcyclohexa-3,5-diene-1,2-dicarboxylic acid hydrochloride
Traditional Name:3-amino-1-(2-diethylaminoethyl)-2-propyl-cyclohexa-3,5-diene-1,2-dicarboxylic acid hydrochloride
Formula: C17H29ClN2O4
MolecularWeight: 360.87616
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Descriptors Computed from Structure

Canonical SMILES:

CCCC1(C(=CC=CC1(CCN(CC)CC)C(=O)O)N)C(=O)O.Cl


Isomeric SMILES

CCCC1(C(=CC=CC1(CCN(CC)CC)C(=O)O)N)C(=O)O.Cl


InChI

InChI=1S/C17H28N2O4.ClH/c1-4-9-17(15(22)23)13(18)8-7-10-16(17,14(20)21)11-12-19(5-2)6-3;/h7-8,10H,4-6,9,11-12,18H2,1-3H3,(H,20,21)(H,22,23);1H


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