N-[2-(cyclohexen-1-yl)ethyl]-2-[4-(propanoylamino)phenyl]quinoline-4-carboxamide

Systemtic Name: N-[2-(cyclohexen-1-yl)ethyl]-2-[4-(propanoylamino)phenyl]quinoline-4-carboxamide Openeye Name: N-[2-(cyclohexen-1-yl)ethyl]-2-[4-(propanoylamino)phenyl]quinoline-4-carboxamide CAS Name: N-[2-(1-cyclohexenyl)ethyl]-2-[4-(1-oxopropylamino)phenyl]-4-quinolinecarboxamide IUPAC Name: N-[2-(cyclohexen-1-yl)ethyl]-2-[4-(propanoylamino)phenyl]quinoline-4-carboxamide Traditional Name: N-[2-(cyclohexen-1-yl)ethyl]-2-(4-propionamidophenyl)cinchoninamide Formula: C27H29N3O2 MolecularWeight: 427.53806

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)NC1=CC=C(C=C1)C2=NC3=CC=CC=C3C(=C2)C(=O)NCCC4=CCCCC4

Isomeric SMILES

CCC(=O)NC1=CC=C(C=C1)C2=NC3=CC=CC=C3C(=C2)C(=O)NCCC4=CCCCC4

InChI

InChI=1S/C27H29N3O2/c1-2-26(31)29-21-14-12-20(13-15-21)25-18-23(22-10-6-7-11-24(22)30-25)27(32)28-17-16-19-8-4-3-5-9-19/h6-8,10-15,18H,2-5,9,16-17H2,1H3,(H,28,32)(H,29,31)