4-methoxy-N-[(2S)-3-(4-methoxyphenoxy)-2-oxidanyl-propyl]-3-nitro-benzamide

Systemtic Name: 4-methoxy-N-[(2S)-3-(4-methoxyphenoxy)-2-oxidanyl-propyl]-3-nitro-benzamide Openeye Name: N-[(2S)-2-hydroxy-3-(4-methoxyphenoxy)propyl]-4-methoxy-3-nitro-benzamide CAS Name: N-[(2S)-2-hydroxy-3-(4-methoxyphenoxy)propyl]-4-methoxy-3-nitrobenzamide IUPAC Name: N-[(2S)-2-hydroxy-3-(4-methoxyphenoxy)propyl]-4-methoxy-3-nitrobenzamide Traditional Name: N-[(2S)-2-hydroxy-3-(4-methoxyphenoxy)propyl]-4-methoxy-3-nitro-benzamide Formula: C18H20N2O7 MolecularWeight: 376.3606

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)OCC(CNC(=O)C2=CC(=C(C=C2)OC)[N+](=O)[O-])O

Isomeric SMILES

COC1=CC=C(C=C1)OC[C@H](CNC(=O)C2=CC(=C(C=C2)OC)[N+](=O)[O-])O

InChI

InChI=1S/C18H20N2O7/c1-25-14-4-6-15(7-5-14)27-11-13(21)10-19-18(22)12-3-8-17(26-2)16(9-12)20(23)24/h3-9,13,21H,10-11H2,1-2H3,(H,19,22)/t13-/m0/s1