4,5-bis(chloranyl)-N-[3-(2-cyanoethyl)-2-oxidanylidene-1-pentyl-indol-3-yl]cyclohexa-1,3-diene-1-carboxamide

Systemtic Name: 4,5-bis(chloranyl)-N-[3-(2-cyanoethyl)-2-oxidanylidene-1-pentyl-indol-3-yl]cyclohexa-1,3-diene-1-carboxamide Openeye Name: 4,5-dichloro-N-[3-(2-cyanoethyl)-2-oxo-1-pentyl-indolin-3-yl]cyclohexa-1,3-diene-1-carboxamide CAS Name: 4,5-dichloro-N-[3-(2-cyanoethyl)-2-oxo-1-pentyl-3-indolyl]-1-cyclohexa-1,3-dienecarboxamide IUPAC Name: 4,5-dichloro-N-[3-(2-cyanoethyl)-2-oxo-1-pentylindol-3-yl]cyclohexa-1,3-diene-1-carboxamide Traditional Name: N-[1-amyl-3-(2-cyanoethyl)-2-keto-indolin-3-yl]-4,5-dichloro-cyclohexa-1,3-diene-1-carboxamide Formula: C23H25Cl2N3O2 MolecularWeight: 446.3695

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCN1C2=CC=CC=C2C(C1=O)(CCC#N)NC(=O)C3=CC=C(C(C3)Cl)Cl

Isomeric SMILES

CCCCCN1C2=CC=CC=C2C(C1=O)(CCC#N)NC(=O)C3=CC=C(C(C3)Cl)Cl

InChI

InChI=1S/C23H25Cl2N3O2/c1-2-3-6-14-28-20-9-5-4-8-17(20)23(22(28)30,12-7-13-26)27-21(29)16-10-11-18(24)19(25)15-16/h4-5,8-11,19H,2-3,6-7,12,14-15H2,1H3,(H,27,29)