[(2,3-diethylphenyl)carbonylamino]-(3-hydroxyphenyl)-(1H-imidazol-5-ylmethyl)-piperidin-4-yl-azanium

Systemtic Name: [(2,3-diethylphenyl)carbonylamino]-(3-hydroxyphenyl)-(1H-imidazol-5-ylmethyl)-piperidin-4-yl-azanium Openeye Name: [(2,3-diethylbenzoyl)amino]-(3-hydroxyphenyl)-(1H-imidazol-5-ylmethyl)-(4-piperidyl)ammonium CAS Name: [[(2,3-diethylphenyl)-oxomethyl]amino]-(3-hydroxyphenyl)-(1H-imidazol-5-ylmethyl)-(4-piperidinyl)ammonium IUPAC Name: [(2,3-diethylbenzoyl)amino]-(3-hydroxyphenyl)-(1H-imidazol-5-ylmethyl)-piperidin-4-ylazanium Traditional Name: [(2,3-diethylbenzoyl)amino]-(3-hydroxyphenyl)-(1H-imidazol-5-ylmethyl)-(4-piperidyl)ammonium Formula: C26H34N5O2+ MolecularWeight: 448.58046

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC(=C1CC)C(=O)N[N+](CC2=CN=CN2)(C3CCNCC3)C4=CC(=CC=C4)O

Isomeric SMILES

CCC1=CC=CC(=C1CC)C(=O)N[N+](CC2=CN=CN2)(C3CCNCC3)C4=CC(=CC=C4)O

InChI

InChI=1S/C26H33N5O2/c1-3-19-7-5-10-25(24(19)4-2)26(33)30-31(17-20-16-28-18-29-20,21-11-13-27-14-12-21)22-8-6-9-23(32)15-22/h5-10,15-16,18,21,27H,3-4,11-14,17H2,1-2H3,(H2-,28,29,30,32,33)/p+1