2-(1-azanylbutyl)-N-[4-methyl-1-[(4-nitrophenyl)amino]-1-oxidanylidene-pentan-2-yl]-1,3-oxazole-4-carboxamide

Systemtic Name: 2-(1-azanylbutyl)-N-[4-methyl-1-[(4-nitrophenyl)amino]-1-oxidanylidene-pentan-2-yl]-1,3-oxazole-4-carboxamide Openeye Name: 2-(1-aminobutyl)-N-[3-methyl-1-[(4-nitrophenyl)carbamoyl]butyl]oxazole-4-carboxamide CAS Name: 2-(1-aminobutyl)-N-[4-methyl-1-(4-nitroanilino)-1-oxopentan-2-yl]-4-oxazolecarboxamide IUPAC Name: 2-(1-aminobutyl)-N-[4-methyl-1-(4-nitroanilino)-1-oxopentan-2-yl]-1,3-oxazole-4-carboxamide Traditional Name: 2-(1-aminobutyl)-N-[3-methyl-1-[(4-nitrophenyl)carbamoyl]butyl]oxazole-4-carboxamide Formula: C20H27N5O5 MolecularWeight: 417.45888

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C1=NC(=CO1)C(=O)NC(CC(C)C)C(=O)NC2=CC=C(C=C2)[N+](=O)[O-])N

Isomeric SMILES

CCCC(C1=NC(=CO1)C(=O)NC(CC(C)C)C(=O)NC2=CC=C(C=C2)[N+](=O)[O-])N

InChI

InChI=1S/C20H27N5O5/c1-4-5-15(21)20-24-17(11-30-20)19(27)23-16(10-12(2)3)18(26)22-13-6-8-14(9-7-13)25(28)29/h6-9,11-12,15-16H,4-5,10,21H2,1-3H3,(H,22,26)(H,23,27)