1-(3-methoxyphenyl)-3-[1-[(E)-3-(4-nitrophenyl)prop-2-enyl]-4-oxidanylidene-3H-phthalazin-6-yl]urea

Systemtic Name: 1-(3-methoxyphenyl)-3-[1-[(E)-3-(4-nitrophenyl)prop-2-enyl]-4-oxidanylidene-3H-phthalazin-6-yl]urea Openeye Name: 1-(3-methoxyphenyl)-3-[1-[(E)-3-(4-nitrophenyl)allyl]-4-oxo-3H-phthalazin-6-yl]urea CAS Name: 1-(3-methoxyphenyl)-3-[1-[(E)-3-(4-nitrophenyl)prop-2-enyl]-4-oxo-3H-phthalazin-6-yl]urea IUPAC Name: 1-(3-methoxyphenyl)-3-[1-[(E)-3-(4-nitrophenyl)prop-2-enyl]-4-oxo-3H-phthalazin-6-yl]urea Traditional Name: 1-[4-keto-1-[(E)-3-(4-nitrophenyl)allyl]-3H-phthalazin-6-yl]-3-(3-methoxyphenyl)urea Formula: C25H21N5O5 MolecularWeight: 471.46474

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)NC(=O)NC2=CC3=C(C=C2)C(=NNC3=O)CC=CC4=CC=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

COC1=CC=CC(=C1)NC(=O)NC2=CC3=C(C=C2)C(=NNC3=O)C/C=C/C4=CC=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C25H21N5O5/c1-35-20-6-3-5-17(14-20)26-25(32)27-18-10-13-21-22(15-18)24(31)29-28-23(21)7-2-4-16-8-11-19(12-9-16)30(33)34/h2-6,8-15H,7H2,1H3,(H,29,31)(H2,26,27,32)/b4-2+