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

Systemtic Name: 3-[[4-chloranyl-2,5-bis(oxidanylidene)-1-phenethyl-pyrrol-3-yl]amino]-N-cycloheptyl-benzamide Openeye Name: 3-[(4-chloro-2,5-dioxo-1-phenethyl-pyrrol-3-yl)amino]-N-cycloheptyl-benzamide CAS Name: 3-[(4-chloro-2,5-dioxo-1-phenethyl-3-pyrrolyl)amino]-N-cycloheptylbenzamide IUPAC Name: 3-[(4-chloro-2,5-dioxo-1-phenethylpyrrol-3-yl)amino]-N-cycloheptylbenzamide Traditional Name: 3-[(4-chloro-2,5-diketo-1-phenethyl-3-pyrrolin-3-yl)amino]-N-cycloheptyl-benzamide Formula: C26H28ClN3O3 MolecularWeight: 465.97182

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCC(CC1)NC(=O)C2=CC(=CC=C2)NC3=C(C(=O)N(C3=O)CCC4=CC=CC=C4)Cl

Isomeric SMILES

C1CCCC(CC1)NC(=O)C2=CC(=CC=C2)NC3=C(C(=O)N(C3=O)CCC4=CC=CC=C4)Cl

InChI

InChI=1S/C26H28ClN3O3/c27-22-23(26(33)30(25(22)32)16-15-18-9-4-3-5-10-18)28-21-14-8-11-19(17-21)24(31)29-20-12-6-1-2-7-13-20/h3-5,8-11,14,17,20,28H,1-2,6-7,12-13,15-16H2,(H,29,31)