(2S)-2-acetamido-3-methoxy-N-[(4-nitrophenyl)methyl]propanamide

Systemtic Name: (2S)-2-acetamido-3-methoxy-N-[(4-nitrophenyl)methyl]propanamide Openeye Name: (2S)-2-acetamido-3-methoxy-N-[(4-nitrophenyl)methyl]propanamide CAS Name: (2S)-2-acetamido-3-methoxy-N-[(4-nitrophenyl)methyl]propanamide IUPAC Name: (2S)-2-acetamido-3-methoxy-N-[(4-nitrophenyl)methyl]propanamide Traditional Name: (2S)-2-acetamido-3-methoxy-N-(4-nitrobenzyl)propionamide Formula: C13H17N3O5 MolecularWeight: 295.29118

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC(COC)C(=O)NCC1=CC=C(C=C1)[N+](=O)[O-]

Isomeric SMILES

CC(=O)N[C@@H](COC)C(=O)NCC1=CC=C(C=C1)[N+](=O)[O-]

InChI

InChI=1S/C13H17N3O5/c1-9(17)15-12(8-21-2)13(18)14-7-10-3-5-11(6-4-10)16(19)20/h3-6,12H,7-8H2,1-2H3,(H,14,18)(H,15,17)/t12-/m0/s1