N-[4-(2,4-dihydro-1H-benzo[f]isoquinolin-3-yl)butyl]quinoline-3-carboxamide

Systemtic Name: N-[4-(2,4-dihydro-1H-benzo[f]isoquinolin-3-yl)butyl]quinoline-3-carboxamide Openeye Name: N-[4-(2,4-dihydro-1H-benzo[f]isoquinolin-3-yl)butyl]quinoline-3-carboxamide CAS Name: N-[4-(2,4-dihydro-1H-benzo[f]isoquinolin-3-yl)butyl]-3-quinolinecarboxamide IUPAC Name: N-[4-(2,4-dihydro-1H-benzo[f]isoquinolin-3-yl)butyl]quinoline-3-carboxamide Traditional Name: N-[4-(2,4-dihydro-1H-benz[f]isoquinolin-3-yl)butyl]quinoline-3-carboxamide Formula: C27H27N3O MolecularWeight: 409.52278

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC2=C1C3=CC=CC=C3C=C2)CCCCNC(=O)C4=CC5=CC=CC=C5N=C4

Isomeric SMILES

C1CN(CC2=C1C3=CC=CC=C3C=C2)CCCCNC(=O)C4=CC5=CC=CC=C5N=C4

InChI

InChI=1S/C27H27N3O/c31-27(23-17-21-8-2-4-10-26(21)29-18-23)28-14-5-6-15-30-16-13-25-22(19-30)12-11-20-7-1-3-9-24(20)25/h1-4,7-12,17-18H,5-6,13-16,19H2,(H,28,31)