ethyl (E)-2-cyano-3-[1-[2-(4-cyclohexylphenoxy)ethyl]-2-methyl-indol-3-yl]prop-2-enoate

Systemtic Name: ethyl (E)-2-cyano-3-[1-[2-(4-cyclohexylphenoxy)ethyl]-2-methyl-indol-3-yl]prop-2-enoate Openeye Name: ethyl (E)-2-cyano-3-[1-[2-(4-cyclohexylphenoxy)ethyl]-2-methyl-indol-3-yl]prop-2-enoate CAS Name: (E)-2-cyano-3-[1-[2-(4-cyclohexylphenoxy)ethyl]-2-methyl-3-indolyl]-2-propenoic acid ethyl ester IUPAC Name: ethyl (E)-2-cyano-3-[1-[2-(4-cyclohexylphenoxy)ethyl]-2-methylindol-3-yl]prop-2-enoate Traditional Name: (E)-2-cyano-3-[1-[2-(4-cyclohexylphenoxy)ethyl]-2-methyl-indol-3-yl]acrylic acid ethyl ester Formula: C29H32N2O3 MolecularWeight: 456.57598

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(=CC1=C(N(C2=CC=CC=C21)CCOC3=CC=C(C=C3)C4CCCCC4)C)C#N

Isomeric SMILES

CCOC(=O)/C(=C/C1=C(N(C2=CC=CC=C21)CCOC3=CC=C(C=C3)C4CCCCC4)C)/C#N

InChI

InChI=1S/C29H32N2O3/c1-3-33-29(32)24(20-30)19-27-21(2)31(28-12-8-7-11-26(27)28)17-18-34-25-15-13-23(14-16-25)22-9-5-4-6-10-22/h7-8,11-16,19,22H,3-6,9-10,17-18H2,1-2H3/b24-19+