1-[[(E)-2-cyano-3-(3-nitrophenyl)prop-2-enoyl]amino]-3-(4-nitrophenyl)urea

Systemtic Name: 1-[[(E)-2-cyano-3-(3-nitrophenyl)prop-2-enoyl]amino]-3-(4-nitrophenyl)urea Openeye Name: 1-[[(E)-2-cyano-3-(3-nitrophenyl)prop-2-enoyl]amino]-3-(4-nitrophenyl)urea CAS Name: 1-[[(E)-2-cyano-3-(3-nitrophenyl)-1-oxoprop-2-enyl]amino]-3-(4-nitrophenyl)urea IUPAC Name: 1-[[(E)-2-cyano-3-(3-nitrophenyl)prop-2-enoyl]amino]-3-(4-nitrophenyl)urea Traditional Name: 1-[[(E)-2-cyano-3-(3-nitrophenyl)acryloyl]amino]-3-(4-nitrophenyl)urea Formula: C17H12N6O6 MolecularWeight: 396.31378

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)[N+](=O)[O-])C=C(C#N)C(=O)NNC(=O)NC2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CC(=C1)[N+](=O)[O-])/C=C(\C#N)/C(=O)NNC(=O)NC2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C17H12N6O6/c18-10-12(8-11-2-1-3-15(9-11)23(28)29)16(24)20-21-17(25)19-13-4-6-14(7-5-13)22(26)27/h1-9H,(H,20,24)(H2,19,21,25)/b12-8+