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

Systemtic Name: 3-[[1-(4-butylphenyl)-4-chloranyl-2,5-bis(oxidanylidene)pyrrol-3-yl]amino]-N-naphthalen-1-yl-benzamide Openeye Name: 3-[[1-(4-butylphenyl)-4-chloro-2,5-dioxo-pyrrol-3-yl]amino]-N-(1-naphthyl)benzamide CAS Name: 3-[[1-(4-butylphenyl)-4-chloro-2,5-dioxo-3-pyrrolyl]amino]-N-(1-naphthalenyl)benzamide IUPAC Name: 3-[[1-(4-butylphenyl)-4-chloro-2,5-dioxopyrrol-3-yl]amino]-N-naphthalen-1-ylbenzamide Traditional Name: 3-[[1-(4-butylphenyl)-4-chloro-2,5-diketo-3-pyrrolin-3-yl]amino]-N-(1-naphthyl)benzamide Formula: C31H26ClN3O3 MolecularWeight: 524.00944

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)N2C(=O)C(=C(C2=O)Cl)NC3=CC=CC(=C3)C(=O)NC4=CC=CC5=CC=CC=C54

Isomeric SMILES

CCCCC1=CC=C(C=C1)N2C(=O)C(=C(C2=O)Cl)NC3=CC=CC(=C3)C(=O)NC4=CC=CC5=CC=CC=C54

InChI

InChI=1S/C31H26ClN3O3/c1-2-3-8-20-15-17-24(18-16-20)35-30(37)27(32)28(31(35)38)33-23-12-6-11-22(19-23)29(36)34-26-14-7-10-21-9-4-5-13-25(21)26/h4-7,9-19,33H,2-3,8H2,1H3,(H,34,36)