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1-[2-oxidanylidene-2-(3-phenylpropylamino)ethyl]pyridin-1-ium-3-carboxamide

1-[2-oxidanylidene-2-(3-phenylpropylamino)ethyl]pyridin-1-ium-3-carboxamide

Systemtic Name:1-[2-oxidanylidene-2-(3-phenylpropylamino)ethyl]pyridin-1-ium-3-carboxamide
Openeye Name:1-[2-oxo-2-(3-phenylpropylamino)ethyl]pyridin-1-ium-3-carboxamide
CAS Name:1-[2-oxo-2-(3-phenylpropylamino)ethyl]-3-pyridin-1-iumcarboxamide
IUPAC Name:1-[2-oxo-2-(3-phenylpropylamino)ethyl]pyridin-1-ium-3-carboxamide
Traditional Name:1-[2-keto-2-(3-phenylpropylamino)ethyl]pyridin-1-ium-3-carboxamide
Formula: C17H20N3O2+
MolecularWeight: 298.3596
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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCCNC(=O)C[N+]2=CC=CC(=C2)C(=O)N


Isomeric SMILES

C1=CC=C(C=C1)CCCNC(=O)C[N+]2=CC=CC(=C2)C(=O)N


InChI

InChI=1S/C17H19N3O2/c18-17(22)15-9-5-11-20(12-15)13-16(21)19-10-4-8-14-6-2-1-3-7-14/h1-3,5-7,9,11-12H,4,8,10,13H2,(H2-,18,19,21,22)/p+1


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