N-[(Z)-[(1S)-1-morpholin-4-ium-4-yl-1-phenyl-propan-2-ylidene]amino]-2-(2-nitrophenoxy)ethanamide

Systemtic Name: N-[(Z)-[(1S)-1-morpholin-4-ium-4-yl-1-phenyl-propan-2-ylidene]amino]-2-(2-nitrophenoxy)ethanamide Openeye Name: N-[(Z)-[(2S)-1-methyl-2-morpholin-4-ium-4-yl-2-phenyl-ethylidene]amino]-2-(2-nitrophenoxy)acetamide CAS Name: N-[(Z)-[(1S)-1-(4-morpholin-4-iumyl)-1-phenylpropan-2-ylidene]amino]-2-(2-nitrophenoxy)acetamide IUPAC Name: N-[(Z)-[(1S)-1-morpholin-4-ium-4-yl-1-phenylpropan-2-ylidene]amino]-2-(2-nitrophenoxy)acetamide Traditional Name: N-[(Z)-[(2S)-1-methyl-2-morpholin-4-ium-4-yl-2-phenyl-ethylidene]amino]-2-(2-nitrophenoxy)acetamide Formula: C21H25N4O5+ MolecularWeight: 413.447

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Descriptors Computed from Structure

Canonical SMILES:

CC(=NNC(=O)COC1=CC=CC=C1[N+](=O)[O-])C(C2=CC=CC=C2)[NH+]3CCOCC3

Isomeric SMILES

C/C(=N/NC(=O)COC1=CC=CC=C1[N+](=O)[O-])/[C@H](C2=CC=CC=C2)[NH+]3CCOCC3

InChI

InChI=1S/C21H24N4O5/c1-16(21(17-7-3-2-4-8-17)24-11-13-29-14-12-24)22-23-20(26)15-30-19-10-6-5-9-18(19)25(27)28/h2-10,21H,11-15H2,1H3,(H,23,26)/p+1/b22-16-/t21-/m1/s1