N-[2-[methyl(phenethyl)amino]-5aH-cyclohepta[b][1]benzofuran-9-yl]quinoline-2-carboxamide

Systemtic Name: N-[2-[methyl(phenethyl)amino]-5aH-cyclohepta[b][1]benzofuran-9-yl]quinoline-2-carboxamide Openeye Name: N-[2-[methyl(phenethyl)amino]-5aH-cyclohepta[b]benzofuran-9-yl]quinoline-2-carboxamide CAS Name: N-[2-[methyl(phenethyl)amino]-5aH-cyclohepta[b]benzofuran-9-yl]-2-quinolinecarboxamide IUPAC Name: N-[2-[methyl(phenethyl)amino]-5aH-cyclohepta[b][1]benzofuran-9-yl]quinoline-2-carboxamide Traditional Name: N-[2-[methyl(phenethyl)amino]-5aH-cyclohepta[b]benzofuran-9-yl]quinaldamide Formula: C32H27N3O2 MolecularWeight: 485.57568

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Descriptors Computed from Structure

Canonical SMILES:

CN(CCC1=CC=CC=C1)C2=CC3=C(C=C2)OC4C3=CC(=CC=C4)NC(=O)C5=NC6=CC=CC=C6C=C5

Isomeric SMILES

CN(CCC1=CC=CC=C1)C2=CC3=C(C=C2)OC4C3=CC(=CC=C4)NC(=O)C5=NC6=CC=CC=C6C=C5

InChI

InChI=1S/C32H27N3O2/c1-35(19-18-22-8-3-2-4-9-22)25-15-17-31-27(21-25)26-20-24(11-7-13-30(26)37-31)33-32(36)29-16-14-23-10-5-6-12-28(23)34-29/h2-17,20-21,30H,18-19H2,1H3,(H,33,36)