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

Systemtic Name: 3-[[4-chloranyl-2,5-bis(oxidanylidene)-1-(4-propan-2-ylphenyl)pyrrol-3-yl]amino]-N-cycloheptyl-benzamide Openeye Name: 3-[[4-chloro-1-(4-isopropylphenyl)-2,5-dioxo-pyrrol-3-yl]amino]-N-cycloheptyl-benzamide CAS Name: 3-[[4-chloro-2,5-dioxo-1-(4-propan-2-ylphenyl)-3-pyrrolyl]amino]-N-cycloheptylbenzamide IUPAC Name: 3-[[4-chloro-2,5-dioxo-1-(4-propan-2-ylphenyl)pyrrol-3-yl]amino]-N-cycloheptylbenzamide Traditional Name: 3-[(4-chloro-2,5-diketo-1-p-cumenyl-3-pyrrolin-3-yl)amino]-N-cycloheptyl-benzamide Formula: C27H30ClN3O3 MolecularWeight: 479.9984

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)N2C(=O)C(=C(C2=O)Cl)NC3=CC=CC(=C3)C(=O)NC4CCCCCC4

Isomeric SMILES

CC(C)C1=CC=C(C=C1)N2C(=O)C(=C(C2=O)Cl)NC3=CC=CC(=C3)C(=O)NC4CCCCCC4

InChI

InChI=1S/C27H30ClN3O3/c1-17(2)18-12-14-22(15-13-18)31-26(33)23(28)24(27(31)34)29-21-11-7-8-19(16-21)25(32)30-20-9-5-3-4-6-10-20/h7-8,11-17,20,29H,3-6,9-10H2,1-2H3,(H,30,32)