N-[(Z)-anthracen-9-ylmethylideneamino]-1-[(4-chlorophenyl)methyl]piperidin-1-ium-4-carboxamide

Systemtic Name: N-[(Z)-anthracen-9-ylmethylideneamino]-1-[(4-chlorophenyl)methyl]piperidin-1-ium-4-carboxamide Openeye Name: N-[(Z)-9-anthrylmethyleneamino]-1-[(4-chlorophenyl)methyl]piperidin-1-ium-4-carboxamide CAS Name: N-[(Z)-9-anthracenylmethylideneamino]-1-[(4-chlorophenyl)methyl]-4-piperidin-1-iumcarboxamide IUPAC Name: N-[(Z)-anthracen-9-ylmethylideneamino]-1-[(4-chlorophenyl)methyl]piperidin-1-ium-4-carboxamide Traditional Name: N-[(Z)-9-anthrylmethyleneamino]-1-(4-chlorobenzyl)piperidin-1-ium-4-carboxamide Formula: C28H27ClN3O+ MolecularWeight: 456.98648

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CCC1C(=O)NN=CC2=C3C=CC=CC3=CC4=CC=CC=C42)CC5=CC=C(C=C5)Cl

Isomeric SMILES

C1C[NH+](CCC1C(=O)N/N=C\C2=C3C=CC=CC3=CC4=CC=CC=C42)CC5=CC=C(C=C5)Cl

InChI

InChI=1S/C28H26ClN3O/c29-24-11-9-20(10-12-24)19-32-15-13-21(14-16-32)28(33)31-30-18-27-25-7-3-1-5-22(25)17-23-6-2-4-8-26(23)27/h1-12,17-18,21H,13-16,19H2,(H,31,33)/p+1/b30-18-