3-[3-[(E)-3-[2-(4-ethoxyphenyl)pyrrolidin-1-yl]-3-oxidanylidene-prop-1-enyl]indol-1-yl]propanenitrile

Systemtic Name: 3-[3-[(E)-3-[2-(4-ethoxyphenyl)pyrrolidin-1-yl]-3-oxidanylidene-prop-1-enyl]indol-1-yl]propanenitrile Openeye Name: 3-[3-[(E)-3-[2-(4-ethoxyphenyl)pyrrolidin-1-yl]-3-oxo-prop-1-enyl]indol-1-yl]propanenitrile CAS Name: 3-[3-[(E)-3-[2-(4-ethoxyphenyl)-1-pyrrolidinyl]-3-oxoprop-1-enyl]-1-indolyl]propanenitrile IUPAC Name: 3-[3-[(E)-3-[2-(4-ethoxyphenyl)pyrrolidin-1-yl]-3-oxoprop-1-enyl]indol-1-yl]propanenitrile Traditional Name: 3-[3-[(E)-3-keto-3-(2-p-phenetylpyrrolidino)prop-1-enyl]indol-1-yl]propionitrile Formula: C26H27N3O2 MolecularWeight: 413.51148

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C2CCCN2C(=O)C=CC3=CN(C4=CC=CC=C43)CCC#N

Isomeric SMILES

CCOC1=CC=C(C=C1)C2CCCN2C(=O)/C=C/C3=CN(C4=CC=CC=C43)CCC#N

InChI

InChI=1S/C26H27N3O2/c1-2-31-22-13-10-20(11-14-22)24-9-5-18-29(24)26(30)15-12-21-19-28(17-6-16-27)25-8-4-3-7-23(21)25/h3-4,7-8,10-15,19,24H,2,5-6,9,17-18H2,1H3/b15-12+