N-[2-[(4-cyanophenyl)amino]-5-ethyl-cyclohexa-1,5-dien-1-yl]cyclopentanecarboxamide

Systemtic Name: N-[2-[(4-cyanophenyl)amino]-5-ethyl-cyclohexa-1,5-dien-1-yl]cyclopentanecarboxamide Openeye Name: N-[2-(4-cyanoanilino)-5-ethyl-cyclohexa-1,5-dien-1-yl]cyclopentanecarboxamide CAS Name: N-[2-(4-cyanoanilino)-5-ethyl-1-cyclohexa-1,5-dienyl]cyclopentanecarboxamide IUPAC Name: N-[2-(4-cyanoanilino)-5-ethylcyclohexa-1,5-dien-1-yl]cyclopentanecarboxamide Traditional Name: N-[2-(4-cyanoanilino)-5-ethyl-cyclohexa-1,5-dien-1-yl]cyclopentanecarboxamide Formula: C21H25N3O MolecularWeight: 335.4427

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=C(CC1)NC2=CC=C(C=C2)C#N)NC(=O)C3CCCC3

Isomeric SMILES

CCC1=CC(=C(CC1)NC2=CC=C(C=C2)C#N)NC(=O)C3CCCC3

InChI

InChI=1S/C21H25N3O/c1-2-15-9-12-19(23-18-10-7-16(14-22)8-11-18)20(13-15)24-21(25)17-5-3-4-6-17/h7-8,10-11,13,17,23H,2-6,9,12H2,1H3,(H,24,25)