6-(cyclopentylamino)-N-(phenylmethyl)pyridin-1-ium-3-carboxamide

Systemtic Name: 6-(cyclopentylamino)-N-(phenylmethyl)pyridin-1-ium-3-carboxamide Openeye Name: N-benzyl-6-(cyclopentylamino)pyridin-1-ium-3-carboxamide CAS Name: 6-(cyclopentylamino)-N-(phenylmethyl)-3-pyridin-1-iumcarboxamide IUPAC Name: N-benzyl-6-(cyclopentylamino)pyridin-1-ium-3-carboxamide Traditional Name: N-benzyl-6-(cyclopentylamino)pyridin-1-ium-3-carboxamide Formula: C18H22N3O+ MolecularWeight: 296.38678

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)NC2=[NH+]C=C(C=C2)C(=O)NCC3=CC=CC=C3

Isomeric SMILES

C1CCC(C1)NC2=[NH+]C=C(C=C2)C(=O)NCC3=CC=CC=C3

InChI

InChI=1S/C18H21N3O/c22-18(20-12-14-6-2-1-3-7-14)15-10-11-17(19-13-15)21-16-8-4-5-9-16/h1-3,6-7,10-11,13,16H,4-5,8-9,12H2,(H,19,21)(H,20,22)/p+1