4-chloranyl-3-[(2Z)-2-[(1S)-1-morpholin-4-ium-4-yl-1-phenyl-propan-2-ylidene]hydrazinyl]benzoate

Systemtic Name: 4-chloranyl-3-[(2Z)-2-[(1S)-1-morpholin-4-ium-4-yl-1-phenyl-propan-2-ylidene]hydrazinyl]benzoate Openeye Name: 4-chloro-3-[(2Z)-2-[(2S)-1-methyl-2-morpholin-4-ium-4-yl-2-phenyl-ethylidene]hydrazino]benzoate CAS Name: 4-chloro-3-[(2Z)-2-[(1S)-1-(4-morpholin-4-iumyl)-1-phenylpropan-2-ylidene]hydrazinyl]benzoate IUPAC Name: 4-chloro-3-[(2Z)-2-[(1S)-1-morpholin-4-ium-4-yl-1-phenylpropan-2-ylidene]hydrazinyl]benzoate Traditional Name: 4-chloro-3-[(N'Z)-N'-[(2S)-1-methyl-2-morpholin-4-ium-4-yl-2-phenyl-ethylidene]hydrazino]benzoate Formula: C20H22ClN3O3 MolecularWeight: 387.85998

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=NNC1=C(C=CC(=C1)C(=O)[O-])Cl)C(C2=CC=CC=C2)[NH+]3CCOCC3

Isomeric SMILES

C/C(=N/NC1=C(C=CC(=C1)C(=O)[O-])Cl)/[C@H](C2=CC=CC=C2)[NH+]3CCOCC3

InChI

InChI=1S/C20H22ClN3O3/c1-14(22-23-18-13-16(20(25)26)7-8-17(18)21)19(15-5-3-2-4-6-15)24-9-11-27-12-10-24/h2-8,13,19,23H,9-12H2,1H3,(H,25,26)/b22-14-/t19-/m1/s1