3-[2-(4-nitroimidazol-1-yl)ethanoyl-(phenylmethyl)amino]propanamide

Systemtic Name: 3-[2-(4-nitroimidazol-1-yl)ethanoyl-(phenylmethyl)amino]propanamide Openeye Name: 3-[benzyl-[2-(4-nitroimidazol-1-yl)acetyl]amino]propanamide CAS Name: 3-[[2-(4-nitro-1-imidazolyl)-1-oxoethyl]-(phenylmethyl)amino]propanamide IUPAC Name: 3-[benzyl-[2-(4-nitroimidazol-1-yl)acetyl]amino]propanamide Traditional Name: 3-[benzyl-[2-(4-nitroimidazol-1-yl)acetyl]amino]propionamide Formula: C15H17N5O4 MolecularWeight: 331.32658

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN(CCC(=O)N)C(=O)CN2C=C(N=C2)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)CN(CCC(=O)N)C(=O)CN2C=C(N=C2)[N+](=O)[O-]

InChI

InChI=1S/C15H17N5O4/c16-13(21)6-7-19(8-12-4-2-1-3-5-12)15(22)10-18-9-14(17-11-18)20(23)24/h1-5,9,11H,6-8,10H2,(H2,16,21)