N-(2-azanylethyl)-3-(4-nitrophenyl)-2-oxidanyl-propanamide

Systemtic Name: N-(2-azanylethyl)-3-(4-nitrophenyl)-2-oxidanyl-propanamide Openeye Name: N-(2-aminoethyl)-2-hydroxy-3-(4-nitrophenyl)propanamide CAS Name: N-(2-aminoethyl)-2-hydroxy-3-(4-nitrophenyl)propanamide IUPAC Name: N-(2-aminoethyl)-2-hydroxy-3-(4-nitrophenyl)propanamide Traditional Name: N-(2-aminoethyl)-2-hydroxy-3-(4-nitrophenyl)propionamide Formula: C11H15N3O4 MolecularWeight: 253.2545

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CC(C(=O)NCCN)O)[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CC=C1CC(C(=O)NCCN)O)[N+](=O)[O-]

InChI

InChI=1S/C11H15N3O4/c12-5-6-13-11(16)10(15)7-8-1-3-9(4-2-8)14(17)18/h1-4,10,15H,5-7,12H2,(H,13,16)