4-azanyl-1-ethyl-2-(2-piperidin-1-ylethyl)cyclohexa-3,5-diene-1,2-dicarboxylic acid

Systemtic Name: 4-azanyl-1-ethyl-2-(2-piperidin-1-ylethyl)cyclohexa-3,5-diene-1,2-dicarboxylic acid Openeye Name: 4-amino-1-ethyl-2-[2-(1-piperidyl)ethyl]cyclohexa-3,5-diene-1,2-dicarboxylic acid CAS Name: 4-amino-1-ethyl-2-[2-(1-piperidinyl)ethyl]cyclohexa-3,5-diene-1,2-dicarboxylic acid IUPAC Name: 4-amino-1-ethyl-2-(2-piperidin-1-ylethyl)cyclohexa-3,5-diene-1,2-dicarboxylic acid Traditional Name: 4-amino-1-ethyl-2-(2-piperidinoethyl)cyclohexa-3,5-diene-1,2-dicarboxylic acid Formula: C17H26N2O4 MolecularWeight: 322.39934

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Descriptors Computed from Structure

Canonical SMILES:

CCC1(C=CC(=CC1(CCN2CCCCC2)C(=O)O)N)C(=O)O

Isomeric SMILES

CCC1(C=CC(=CC1(CCN2CCCCC2)C(=O)O)N)C(=O)O

InChI

InChI=1S/C17H26N2O4/c1-2-16(14(20)21)7-6-13(18)12-17(16,15(22)23)8-11-19-9-4-3-5-10-19/h6-7,12H,2-5,8-11,18H2,1H3,(H,20,21)(H,22,23)