[4-[(4-morpholin-4-yl-3-nitro-phenyl)carbonylamino]phenyl] thiocyanate

Systemtic Name: [4-[(4-morpholin-4-yl-3-nitro-phenyl)carbonylamino]phenyl] thiocyanate Openeye Name: [4-[(4-morpholino-3-nitro-benzoyl)amino]phenyl] thiocyanate CAS Name: thiocyanic acid [4-[[[4-(4-morpholinyl)-3-nitrophenyl]-oxomethyl]amino]phenyl] ester IUPAC Name: [4-[(4-morpholin-4-yl-3-nitrobenzoyl)amino]phenyl] thiocyanate Traditional Name: thiocyanic acid [4-[(4-morpholino-3-nitro-benzoyl)amino]phenyl] ester Formula: C18H16N4O4S MolecularWeight: 384.40904

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C2=C(C=C(C=C2)C(=O)NC3=CC=C(C=C3)SC#N)[N+](=O)[O-]

Isomeric SMILES

C1COCCN1C2=C(C=C(C=C2)C(=O)NC3=CC=C(C=C3)SC#N)[N+](=O)[O-]

InChI

InChI=1S/C18H16N4O4S/c19-12-27-15-4-2-14(3-5-15)20-18(23)13-1-6-16(17(11-13)22(24)25)21-7-9-26-10-8-21/h1-6,11H,7-10H2,(H,20,23)