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

Systemtic Name: 2-(1-azanyl-2-oxidanyl-ethyl)-N-[4-methyl-1-[(4-nitrophenyl)amino]-1-oxidanylidene-pentan-2-yl]-1,3-oxazole-4-carboxamide Openeye Name: 2-(1-amino-2-hydroxy-ethyl)-N-[3-methyl-1-[(4-nitrophenyl)carbamoyl]butyl]oxazole-4-carboxamide CAS Name: 2-(1-amino-2-hydroxyethyl)-N-[4-methyl-1-(4-nitroanilino)-1-oxopentan-2-yl]-4-oxazolecarboxamide IUPAC Name: 2-(1-amino-2-hydroxyethyl)-N-[4-methyl-1-(4-nitroanilino)-1-oxopentan-2-yl]-1,3-oxazole-4-carboxamide Traditional Name: 2-(1-amino-2-hydroxy-ethyl)-N-[3-methyl-1-[(4-nitrophenyl)carbamoyl]butyl]oxazole-4-carboxamide Formula: C18H23N5O6 MolecularWeight: 405.40512

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)NC1=CC=C(C=C1)[N+](=O)[O-])NC(=O)C2=COC(=N2)C(CO)N

Isomeric SMILES

CC(C)CC(C(=O)NC1=CC=C(C=C1)[N+](=O)[O-])NC(=O)C2=COC(=N2)C(CO)N

InChI

InChI=1S/C18H23N5O6/c1-10(2)7-14(16(25)20-11-3-5-12(6-4-11)23(27)28)21-17(26)15-9-29-18(22-15)13(19)8-24/h3-6,9-10,13-14,24H,7-8,19H2,1-2H3,(H,20,25)(H,21,26)