3-[[4-chloranyl-1-(4-ethoxyphenyl)-2,5-bis(oxidanylidene)pyrrol-3-yl]amino]-N-phenethyl-benzamide

Systemtic Name: 3-[[4-chloranyl-1-(4-ethoxyphenyl)-2,5-bis(oxidanylidene)pyrrol-3-yl]amino]-N-phenethyl-benzamide Openeye Name: 3-[[4-chloro-1-(4-ethoxyphenyl)-2,5-dioxo-pyrrol-3-yl]amino]-N-phenethyl-benzamide CAS Name: 3-[[4-chloro-1-(4-ethoxyphenyl)-2,5-dioxo-3-pyrrolyl]amino]-N-phenethylbenzamide IUPAC Name: 3-[[4-chloro-1-(4-ethoxyphenyl)-2,5-dioxopyrrol-3-yl]amino]-N-phenethylbenzamide Traditional Name: 3-[(4-chloro-2,5-diketo-1-p-phenetyl-3-pyrrolin-3-yl)amino]-N-phenethyl-benzamide Formula: C27H24ClN3O4 MolecularWeight: 489.95016

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)N2C(=O)C(=C(C2=O)Cl)NC3=CC=CC(=C3)C(=O)NCCC4=CC=CC=C4

Isomeric SMILES

CCOC1=CC=C(C=C1)N2C(=O)C(=C(C2=O)Cl)NC3=CC=CC(=C3)C(=O)NCCC4=CC=CC=C4

InChI

InChI=1S/C27H24ClN3O4/c1-2-35-22-13-11-21(12-14-22)31-26(33)23(28)24(27(31)34)30-20-10-6-9-19(17-20)25(32)29-16-15-18-7-4-3-5-8-18/h3-14,17,30H,2,15-16H2,1H3,(H,29,32)