N-cyclohexyl-2-[[4-(1,2,3,4-tetrahydroisoquinolin-2-ium-2-ylmethyl)phenyl]carbonylamino]benzamide

Systemtic Name: N-cyclohexyl-2-[[4-(1,2,3,4-tetrahydroisoquinolin-2-ium-2-ylmethyl)phenyl]carbonylamino]benzamide Openeye Name: N-cyclohexyl-2-[[4-(1,2,3,4-tetrahydroisoquinolin-2-ium-2-ylmethyl)benzoyl]amino]benzamide CAS Name: N-cyclohexyl-2-[[oxo-[4-(1,2,3,4-tetrahydroisoquinolin-2-ium-2-ylmethyl)phenyl]methyl]amino]benzamide IUPAC Name: N-cyclohexyl-2-[[4-(1,2,3,4-tetrahydroisoquinolin-2-ium-2-ylmethyl)benzoyl]amino]benzamide Traditional Name: N-cyclohexyl-2-[[4-(1,2,3,4-tetrahydroisoquinolin-2-ium-2-ylmethyl)benzoyl]amino]benzamide Formula: C30H34N3O2+ MolecularWeight: 468.60986

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)NC(=O)C2=CC=CC=C2NC(=O)C3=CC=C(C=C3)C[NH+]4CCC5=CC=CC=C5C4

Isomeric SMILES

C1CCC(CC1)NC(=O)C2=CC=CC=C2NC(=O)C3=CC=C(C=C3)C[NH+]4CCC5=CC=CC=C5C4

InChI

InChI=1S/C30H33N3O2/c34-29(32-28-13-7-6-12-27(28)30(35)31-26-10-2-1-3-11-26)24-16-14-22(15-17-24)20-33-19-18-23-8-4-5-9-25(23)21-33/h4-9,12-17,26H,1-3,10-11,18-21H2,(H,31,35)(H,32,34)/p+1