2-(1-azanylbutyl)-N-methyl-N-[2-(4-nitrophenyl)ethyl]-1,3-oxazole-4-carboxamide

Systemtic Name: 2-(1-azanylbutyl)-N-methyl-N-[2-(4-nitrophenyl)ethyl]-1,3-oxazole-4-carboxamide Openeye Name: 2-(1-aminobutyl)-N-methyl-N-[2-(4-nitrophenyl)ethyl]oxazole-4-carboxamide CAS Name: 2-(1-aminobutyl)-N-methyl-N-[2-(4-nitrophenyl)ethyl]-4-oxazolecarboxamide IUPAC Name: 2-(1-aminobutyl)-N-methyl-N-[2-(4-nitrophenyl)ethyl]-1,3-oxazole-4-carboxamide Traditional Name: 2-(1-aminobutyl)-N-methyl-N-[2-(4-nitrophenyl)ethyl]oxazole-4-carboxamide Formula: C17H22N4O4 MolecularWeight: 346.38098

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C1=NC(=CO1)C(=O)N(C)CCC2=CC=C(C=C2)[N+](=O)[O-])N

Isomeric SMILES

CCCC(C1=NC(=CO1)C(=O)N(C)CCC2=CC=C(C=C2)[N+](=O)[O-])N

InChI

InChI=1S/C17H22N4O4/c1-3-4-14(18)16-19-15(11-25-16)17(22)20(2)10-9-12-5-7-13(8-6-12)21(23)24/h5-8,11,14H,3-4,9-10,18H2,1-2H3