N-(4-nitrophenyl)-2-(phenethylamino)pyridin-1-ium-3-carboxamide

Systemtic Name: N-(4-nitrophenyl)-2-(phenethylamino)pyridin-1-ium-3-carboxamide Openeye Name: N-(4-nitrophenyl)-2-(phenethylamino)pyridin-1-ium-3-carboxamide CAS Name: N-(4-nitrophenyl)-2-(phenethylamino)-3-pyridin-1-iumcarboxamide IUPAC Name: N-(4-nitrophenyl)-2-(phenethylamino)pyridin-1-ium-3-carboxamide Traditional Name: N-(4-nitrophenyl)-2-(phenethylamino)pyridin-1-ium-3-carboxamide Formula: C20H19N4O3+ MolecularWeight: 363.38986

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCNC2=C(C=CC=[NH+]2)C(=O)NC3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)CCNC2=C(C=CC=[NH+]2)C(=O)NC3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C20H18N4O3/c25-20(23-16-8-10-17(11-9-16)24(26)27)18-7-4-13-21-19(18)22-14-12-15-5-2-1-3-6-15/h1-11,13H,12,14H2,(H,21,22)(H,23,25)/p+1