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tricyclohexyl-(3,5-dicarboxyphenyl)carbonyl-azanium

tricyclohexyl-(3,5-dicarboxyphenyl)carbonyl-azanium

Systemtic Name:tricyclohexyl-(3,5-dicarboxyphenyl)carbonyl-azanium
Openeye Name:tricyclohexyl-(3,5-dicarboxybenzoyl)ammonium
CAS Name:tricyclohexyl-[(3,5-dicarboxyphenyl)-oxomethyl]ammonium
IUPAC Name:tricyclohexyl-(3,5-dicarboxybenzoyl)azanium
Traditional Name:tricyclohexyl-(3,5-dicarboxybenzoyl)ammonium
Formula: C27H38NO5+
MolecularWeight: 456.59432
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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)[N+](C2CCCCC2)(C3CCCCC3)C(=O)C4=CC(=CC(=C4)C(=O)O)C(=O)O


Isomeric SMILES

C1CCC(CC1)[N+](C2CCCCC2)(C3CCCCC3)C(=O)C4=CC(=CC(=C4)C(=O)O)C(=O)O


InChI

InChI=1S/C27H37NO5/c29-25(19-16-20(26(30)31)18-21(17-19)27(32)33)28(22-10-4-1-5-11-22,23-12-6-2-7-13-23)24-14-8-3-9-15-24/h16-18,22-24H,1-15H2,(H-,30,31,32,33)/p+1


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