4-[[4-chloranyl-2,5-bis(oxidanylidene)-1-(phenylmethyl)pyrrol-3-yl]amino]-N-[2-(3,4-dimethoxyphenyl)ethyl]benzamide

Systemtic Name: 4-[[4-chloranyl-2,5-bis(oxidanylidene)-1-(phenylmethyl)pyrrol-3-yl]amino]-N-[2-(3,4-dimethoxyphenyl)ethyl]benzamide Openeye Name: 4-[(1-benzyl-4-chloro-2,5-dioxo-pyrrol-3-yl)amino]-N-[2-(3,4-dimethoxyphenyl)ethyl]benzamide CAS Name: 4-[[4-chloro-2,5-dioxo-1-(phenylmethyl)-3-pyrrolyl]amino]-N-[2-(3,4-dimethoxyphenyl)ethyl]benzamide IUPAC Name: 4-[(1-benzyl-4-chloro-2,5-dioxopyrrol-3-yl)amino]-N-[2-(3,4-dimethoxyphenyl)ethyl]benzamide Traditional Name: 4-[(1-benzyl-4-chloro-2,5-diketo-3-pyrrolin-3-yl)amino]-N-homoveratryl-benzamide Formula: C28H26ClN3O5 MolecularWeight: 519.97614

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CCNC(=O)C2=CC=C(C=C2)NC3=C(C(=O)N(C3=O)CC4=CC=CC=C4)Cl)OC

Isomeric SMILES

COC1=C(C=C(C=C1)CCNC(=O)C2=CC=C(C=C2)NC3=C(C(=O)N(C3=O)CC4=CC=CC=C4)Cl)OC

InChI

InChI=1S/C28H26ClN3O5/c1-36-22-13-8-18(16-23(22)37-2)14-15-30-26(33)20-9-11-21(12-10-20)31-25-24(29)27(34)32(28(25)35)17-19-6-4-3-5-7-19/h3-13,16,31H,14-15,17H2,1-2H3,(H,30,33)