2-methoxyethyl (Z)-2-cyano-3-[1-(phenylmethyl)indol-3-yl]prop-2-enoate

Systemtic Name: 2-methoxyethyl (Z)-2-cyano-3-[1-(phenylmethyl)indol-3-yl]prop-2-enoate Openeye Name: 2-methoxyethyl (Z)-3-(1-benzylindol-3-yl)-2-cyano-prop-2-enoate CAS Name: (Z)-2-cyano-3-[1-(phenylmethyl)-3-indolyl]-2-propenoic acid 2-methoxyethyl ester IUPAC Name: 2-methoxyethyl (Z)-3-(1-benzylindol-3-yl)-2-cyanoprop-2-enoate Traditional Name: (Z)-3-(1-benzylindol-3-yl)-2-cyano-acrylic acid 2-methoxyethyl ester Formula: C22H20N2O3 MolecularWeight: 360.4058

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Descriptors Computed from Structure

Canonical SMILES:

COCCOC(=O)C(=CC1=CN(C2=CC=CC=C21)CC3=CC=CC=C3)C#N

Isomeric SMILES

COCCOC(=O)/C(=C\C1=CN(C2=CC=CC=C21)CC3=CC=CC=C3)/C#N

InChI

InChI=1S/C22H20N2O3/c1-26-11-12-27-22(25)18(14-23)13-19-16-24(15-17-7-3-2-4-8-17)21-10-6-5-9-20(19)21/h2-10,13,16H,11-12,15H2,1H3/b18-13-