N-[2-[(4-nitrophenyl)amino]-3-propan-2-yl-4,5-dihydro-1,3-oxazol-3-ium-4-yl]benzamide

Systemtic Name: N-[2-[(4-nitrophenyl)amino]-3-propan-2-yl-4,5-dihydro-1,3-oxazol-3-ium-4-yl]benzamide Openeye Name: N-[3-isopropyl-2-(4-nitroanilino)-4,5-dihydrooxazol-3-ium-4-yl]benzamide CAS Name: N-[2-(4-nitroanilino)-3-propan-2-yl-4,5-dihydrooxazol-3-ium-4-yl]benzamide IUPAC Name: N-[2-(4-nitroanilino)-3-propan-2-yl-4,5-dihydro-1,3-oxazol-3-ium-4-yl]benzamide Traditional Name: N-[3-isopropyl-2-(4-nitroanilino)-2-oxazolin-3-ium-4-yl]benzamide Formula: C19H21N4O4+ MolecularWeight: 369.39444

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)[N+]1=C(OCC1NC(=O)C2=CC=CC=C2)NC3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CC(C)[N+]1=C(OCC1NC(=O)C2=CC=CC=C2)NC3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C19H20N4O4/c1-13(2)22-17(21-18(24)14-6-4-3-5-7-14)12-27-19(22)20-15-8-10-16(11-9-15)23(25)26/h3-11,13,17H,12H2,1-2H3,(H,21,24)/p+1