[1-oxidanylidene-1-[(4-phenoxyphenyl)amino]butan-2-yl] 4-(4-chlorophenyl)-2-methyl-1-oxidanylidene-isoquinoline-3-carboxylate

Systemtic Name: [1-oxidanylidene-1-[(4-phenoxyphenyl)amino]butan-2-yl] 4-(4-chlorophenyl)-2-methyl-1-oxidanylidene-isoquinoline-3-carboxylate Openeye Name: 1-[(4-phenoxyphenyl)carbamoyl]propyl 4-(4-chlorophenyl)-2-methyl-1-oxo-isoquinoline-3-carboxylate CAS Name: 4-(4-chlorophenyl)-2-methyl-1-oxo-3-isoquinolinecarboxylic acid [1-oxo-1-(4-phenoxyanilino)butan-2-yl] ester IUPAC Name: [1-oxo-1-(4-phenoxyanilino)butan-2-yl] 4-(4-chlorophenyl)-2-methyl-1-oxoisoquinoline-3-carboxylate Traditional Name: 4-(4-chlorophenyl)-1-keto-2-methyl-isoquinoline-3-carboxylic acid 1-[(4-phenoxyphenyl)carbamoyl]propyl ester Formula: C33H27ClN2O5 MolecularWeight: 567.03088

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NC1=CC=C(C=C1)OC2=CC=CC=C2)OC(=O)C3=C(C4=CC=CC=C4C(=O)N3C)C5=CC=C(C=C5)Cl

Isomeric SMILES

CCC(C(=O)NC1=CC=C(C=C1)OC2=CC=CC=C2)OC(=O)C3=C(C4=CC=CC=C4C(=O)N3C)C5=CC=C(C=C5)Cl

InChI

InChI=1S/C33H27ClN2O5/c1-3-28(31(37)35-23-17-19-25(20-18-23)40-24-9-5-4-6-10-24)41-33(39)30-29(21-13-15-22(34)16-14-21)26-11-7-8-12-27(26)32(38)36(30)2/h4-20,28H,3H2,1-2H3,(H,35,37)