ethyl (Z)-3-[3-[2-chloranylethanoyl(phenyl)amino]-1H-indol-2-yl]-2-cyano-prop-2-enoate

Systemtic Name: ethyl (Z)-3-[3-[2-chloranylethanoyl(phenyl)amino]-1H-indol-2-yl]-2-cyano-prop-2-enoate Openeye Name: ethyl (Z)-3-[3-(N-(2-chloroacetyl)anilino)-1H-indol-2-yl]-2-cyano-prop-2-enoate CAS Name: (Z)-3-[3-(N-(2-chloro-1-oxoethyl)anilino)-1H-indol-2-yl]-2-cyano-2-propenoic acid ethyl ester IUPAC Name: ethyl (Z)-3-[3-(N-(2-chloroacetyl)anilino)-1H-indol-2-yl]-2-cyanoprop-2-enoate Traditional Name: (Z)-3-[3-(N-(2-chloroacetyl)anilino)-1H-indol-2-yl]-2-cyano-acrylic acid ethyl ester Formula: C22H18ClN3O3 MolecularWeight: 407.84962

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(=CC1=C(C2=CC=CC=C2N1)N(C3=CC=CC=C3)C(=O)CCl)C#N

Isomeric SMILES

CCOC(=O)/C(=C\C1=C(C2=CC=CC=C2N1)N(C3=CC=CC=C3)C(=O)CCl)/C#N

InChI

InChI=1S/C22H18ClN3O3/c1-2-29-22(28)15(14-24)12-19-21(17-10-6-7-11-18(17)25-19)26(20(27)13-23)16-8-4-3-5-9-16/h3-12,25H,2,13H2,1H3/b15-12-