N-[(4-methylphenyl)methyl]-3-(3-nitrophenyl)-4,5-dihydro-1,2-oxazole-5-carboxamide

Systemtic Name: N-[(4-methylphenyl)methyl]-3-(3-nitrophenyl)-4,5-dihydro-1,2-oxazole-5-carboxamide Openeye Name: 3-(3-nitrophenyl)-N-(p-tolylmethyl)-4,5-dihydroisoxazole-5-carboxamide CAS Name: N-[(4-methylphenyl)methyl]-3-(3-nitrophenyl)-4,5-dihydroisoxazole-5-carboxamide IUPAC Name: N-[(4-methylphenyl)methyl]-3-(3-nitrophenyl)-4,5-dihydro-1,2-oxazole-5-carboxamide Traditional Name: N-(4-methylbenzyl)-3-(3-nitrophenyl)-2-isoxazoline-5-carboxamide Formula: C18H17N3O4 MolecularWeight: 339.34528

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CNC(=O)C2CC(=NO2)C3=CC(=CC=C3)[N+](=O)[O-]

Isomeric SMILES

CC1=CC=C(C=C1)CNC(=O)C2CC(=NO2)C3=CC(=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C18H17N3O4/c1-12-5-7-13(8-6-12)11-19-18(22)17-10-16(20-25-17)14-3-2-4-15(9-14)21(23)24/h2-9,17H,10-11H2,1H3,(H,19,22)