4-[[2-ethyl-4-(2-pyrrolidin-1-ylethoxy)cyclohexa-1,3-dien-1-yl]amino]benzenecarbonitrile

Systemtic Name: 4-[[2-ethyl-4-(2-pyrrolidin-1-ylethoxy)cyclohexa-1,3-dien-1-yl]amino]benzenecarbonitrile Openeye Name: 4-[[2-ethyl-4-(2-pyrrolidin-1-ylethoxy)cyclohexa-1,3-dien-1-yl]amino]benzonitrile CAS Name: 4-[[2-ethyl-4-[2-(1-pyrrolidinyl)ethoxy]-1-cyclohexa-1,3-dienyl]amino]benzonitrile IUPAC Name: 4-[[2-ethyl-4-(2-pyrrolidin-1-ylethoxy)cyclohexa-1,3-dien-1-yl]amino]benzonitrile Traditional Name: 4-[[2-ethyl-4-(2-pyrrolidinoethoxy)cyclohexa-1,3-dien-1-yl]amino]benzonitrile Formula: C21H27N3O MolecularWeight: 337.45858

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(CCC(=C1)OCCN2CCCC2)NC3=CC=C(C=C3)C#N

Isomeric SMILES

CCC1=C(CCC(=C1)OCCN2CCCC2)NC3=CC=C(C=C3)C#N

InChI

InChI=1S/C21H27N3O/c1-2-18-15-20(25-14-13-24-11-3-4-12-24)9-10-21(18)23-19-7-5-17(16-22)6-8-19/h5-8,15,23H,2-4,9-14H2,1H3