(E)-3-[1-[2-(4-chloranylphenoxy)ethyl]indol-3-yl]-2-cyano-N-cycloheptyl-prop-2-enamide

Systemtic Name: (E)-3-[1-[2-(4-chloranylphenoxy)ethyl]indol-3-yl]-2-cyano-N-cycloheptyl-prop-2-enamide Openeye Name: (E)-3-[1-[2-(4-chlorophenoxy)ethyl]indol-3-yl]-2-cyano-N-cycloheptyl-prop-2-enamide CAS Name: (E)-3-[1-[2-(4-chlorophenoxy)ethyl]-3-indolyl]-2-cyano-N-cycloheptyl-2-propenamide IUPAC Name: (E)-3-[1-[2-(4-chlorophenoxy)ethyl]indol-3-yl]-2-cyano-N-cycloheptylprop-2-enamide Traditional Name: (E)-3-[1-[2-(4-chlorophenoxy)ethyl]indol-3-yl]-2-cyano-N-cycloheptyl-acrylamide Formula: C27H28ClN3O2 MolecularWeight: 461.98312

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCC(CC1)NC(=O)C(=CC2=CN(C3=CC=CC=C32)CCOC4=CC=C(C=C4)Cl)C#N

Isomeric SMILES

C1CCCC(CC1)NC(=O)/C(=C/C2=CN(C3=CC=CC=C32)CCOC4=CC=C(C=C4)Cl)/C#N

InChI

InChI=1S/C27H28ClN3O2/c28-22-11-13-24(14-12-22)33-16-15-31-19-21(25-9-5-6-10-26(25)31)17-20(18-29)27(32)30-23-7-3-1-2-4-8-23/h5-6,9-14,17,19,23H,1-4,7-8,15-16H2,(H,30,32)/b20-17+