4-[[3-[1-(2-propylpentanoyl)pyrrolidin-3-yl]indol-1-yl]methyl]benzenecarbonitrile

Systemtic Name: 4-[[3-[1-(2-propylpentanoyl)pyrrolidin-3-yl]indol-1-yl]methyl]benzenecarbonitrile Openeye Name: 4-[[3-[1-(2-propylpentanoyl)pyrrolidin-3-yl]indol-1-yl]methyl]benzonitrile CAS Name: 4-[[3-[1-(1-oxo-2-propylpentyl)-3-pyrrolidinyl]-1-indolyl]methyl]benzonitrile IUPAC Name: 4-[[3-[1-(2-propylpentanoyl)pyrrolidin-3-yl]indol-1-yl]methyl]benzonitrile Traditional Name: 4-[[3-[1-(2-propylpentanoyl)pyrrolidin-3-yl]indol-1-yl]methyl]benzonitrile Formula: C28H33N3O MolecularWeight: 427.58112

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(CCC)C(=O)N1CCC(C1)C2=CN(C3=CC=CC=C32)CC4=CC=C(C=C4)C#N

Isomeric SMILES

CCCC(CCC)C(=O)N1CCC(C1)C2=CN(C3=CC=CC=C32)CC4=CC=C(C=C4)C#N

InChI

InChI=1S/C28H33N3O/c1-3-7-23(8-4-2)28(32)30-16-15-24(19-30)26-20-31(27-10-6-5-9-25(26)27)18-22-13-11-21(17-29)12-14-22/h5-6,9-14,20,23-24H,3-4,7-8,15-16,18-19H2,1-2H3