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

Systemtic Name: 1-[[(E)-2-cyano-3-(3-nitrophenyl)prop-2-enoyl]amino]-3-(4-methylphenyl)urea Openeye Name: 1-[[(E)-2-cyano-3-(3-nitrophenyl)prop-2-enoyl]amino]-3-(p-tolyl)urea CAS Name: 1-[[(E)-2-cyano-3-(3-nitrophenyl)-1-oxoprop-2-enyl]amino]-3-(4-methylphenyl)urea IUPAC Name: 1-[[(E)-2-cyano-3-(3-nitrophenyl)prop-2-enoyl]amino]-3-(4-methylphenyl)urea Traditional Name: 1-[[(E)-2-cyano-3-(3-nitrophenyl)acryloyl]amino]-3-(p-tolyl)urea Formula: C18H15N5O4 MolecularWeight: 365.3428

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NC(=O)NNC(=O)C(=CC2=CC(=CC=C2)[N+](=O)[O-])C#N

Isomeric SMILES

CC1=CC=C(C=C1)NC(=O)NNC(=O)/C(=C/C2=CC(=CC=C2)[N+](=O)[O-])/C#N

InChI

InChI=1S/C18H15N5O4/c1-12-5-7-15(8-6-12)20-18(25)22-21-17(24)14(11-19)9-13-3-2-4-16(10-13)23(26)27/h2-10H,1H3,(H,21,24)(H2,20,22,25)/b14-9+