2-azanyl-N-[1-(4-nitrophenyl)-1,3-bis(oxidanyl)propan-2-yl]-3-phenyl-propanamide

Systemtic Name: 2-azanyl-N-[1-(4-nitrophenyl)-1,3-bis(oxidanyl)propan-2-yl]-3-phenyl-propanamide Openeye Name: 2-amino-N-[2-hydroxy-1-(hydroxymethyl)-2-(4-nitrophenyl)ethyl]-3-phenyl-propanamide CAS Name: 2-amino-N-[1,3-dihydroxy-1-(4-nitrophenyl)propan-2-yl]-3-phenylpropanamide IUPAC Name: 2-amino-N-[1,3-dihydroxy-1-(4-nitrophenyl)propan-2-yl]-3-phenylpropanamide Traditional Name: 2-amino-N-[2-hydroxy-1-methylol-2-(4-nitrophenyl)ethyl]-3-phenyl-propionamide Formula: C18H21N3O5 MolecularWeight: 359.37644

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H21N3O5/c19-15(10-12-4-2-1-3-5-12)18(24)20-16(11-22)17(23)13-6-8-14(9-7-13)21(25)26/h1-9,15-17,22-23H,10-11,19H2,(H,20,24)