(E)-3-(7-chloranyl-1,3-benzodioxol-5-yl)-2-[(2-methyl-1H-indol-3-yl)carbonyl]prop-2-enenitrile

Systemtic Name: (E)-3-(7-chloranyl-1,3-benzodioxol-5-yl)-2-[(2-methyl-1H-indol-3-yl)carbonyl]prop-2-enenitrile Openeye Name: (E)-3-(7-chloro-1,3-benzodioxol-5-yl)-2-(2-methyl-1H-indole-3-carbonyl)prop-2-enenitrile CAS Name: (E)-3-(7-chloro-1,3-benzodioxol-5-yl)-2-[(2-methyl-1H-indol-3-yl)-oxomethyl]-2-propenenitrile IUPAC Name: (E)-3-(7-chloro-1,3-benzodioxol-5-yl)-2-(2-methyl-1H-indole-3-carbonyl)prop-2-enenitrile Traditional Name: (E)-3-(7-chloro-1,3-benzodioxol-5-yl)-2-(2-methyl-1H-indole-3-carbonyl)acrylonitrile Formula: C20H13ClN2O3 MolecularWeight: 364.78182

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=CC=CC=C2N1)C(=O)C(=CC3=CC4=C(C(=C3)Cl)OCO4)C#N

Isomeric SMILES

CC1=C(C2=CC=CC=C2N1)C(=O)/C(=C/C3=CC4=C(C(=C3)Cl)OCO4)/C#N

InChI

InChI=1S/C20H13ClN2O3/c1-11-18(14-4-2-3-5-16(14)23-11)19(24)13(9-22)6-12-7-15(21)20-17(8-12)25-10-26-20/h2-8,23H,10H2,1H3/b13-6+