[4-(phenylcarbamoyl)phenyl]methyl 4-oxidanylidene-3-propyl-phthalazine-1-carboxylate

Systemtic Name: [4-(phenylcarbamoyl)phenyl]methyl 4-oxidanylidene-3-propyl-phthalazine-1-carboxylate Openeye Name: [4-(phenylcarbamoyl)phenyl]methyl 4-oxo-3-propyl-phthalazine-1-carboxylate CAS Name: 4-oxo-3-propyl-1-phthalazinecarboxylic acid [4-[anilino(oxo)methyl]phenyl]methyl ester IUPAC Name: [4-(phenylcarbamoyl)phenyl]methyl 4-oxo-3-propylphthalazine-1-carboxylate Traditional Name: 4-keto-3-propyl-phthalazine-1-carboxylic acid [4-(phenylcarbamoyl)benzyl] ester Formula: C26H23N3O4 MolecularWeight: 441.47852

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)OCC3=CC=C(C=C3)C(=O)NC4=CC=CC=C4

Isomeric SMILES

CCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)OCC3=CC=C(C=C3)C(=O)NC4=CC=CC=C4

InChI

InChI=1S/C26H23N3O4/c1-2-16-29-25(31)22-11-7-6-10-21(22)23(28-29)26(32)33-17-18-12-14-19(15-13-18)24(30)27-20-8-4-3-5-9-20/h3-15H,2,16-17H2,1H3,(H,27,30)