2-(cyclohexylamino)-N-(phenylmethyl)pyridin-1-ium-3-carboxamide

Systemtic Name: 2-(cyclohexylamino)-N-(phenylmethyl)pyridin-1-ium-3-carboxamide Openeye Name: N-benzyl-2-(cyclohexylamino)pyridin-1-ium-3-carboxamide CAS Name: 2-(cyclohexylamino)-N-(phenylmethyl)-3-pyridin-1-iumcarboxamide IUPAC Name: N-benzyl-2-(cyclohexylamino)pyridin-1-ium-3-carboxamide Traditional Name: N-benzyl-2-(cyclohexylamino)pyridin-1-ium-3-carboxamide Formula: C19H24N3O+ MolecularWeight: 310.41336

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)NC2=C(C=CC=[NH+]2)C(=O)NCC3=CC=CC=C3

Isomeric SMILES

C1CCC(CC1)NC2=C(C=CC=[NH+]2)C(=O)NCC3=CC=CC=C3

InChI

InChI=1S/C19H23N3O/c23-19(21-14-15-8-3-1-4-9-15)17-12-7-13-20-18(17)22-16-10-5-2-6-11-16/h1,3-4,7-9,12-13,16H,2,5-6,10-11,14H2,(H,20,22)(H,21,23)/p+1