N-[3-(2-oxidanylideneazepan-1-yl)propyl]-2-propan-2-yl-quinoline-4-carboxamide

Systemtic Name: N-[3-(2-oxidanylideneazepan-1-yl)propyl]-2-propan-2-yl-quinoline-4-carboxamide Openeye Name: 2-isopropyl-N-[3-(2-oxoazepan-1-yl)propyl]quinoline-4-carboxamide CAS Name: N-[3-(2-oxo-1-azepanyl)propyl]-2-propan-2-yl-4-quinolinecarboxamide IUPAC Name: N-[3-(2-oxoazepan-1-yl)propyl]-2-propan-2-ylquinoline-4-carboxamide Traditional Name: 2-isopropyl-N-[3-(2-ketoazepan-1-yl)propyl]cinchoninamide Formula: C22H29N3O2 MolecularWeight: 367.48456

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=NC2=CC=CC=C2C(=C1)C(=O)NCCCN3CCCCCC3=O

Isomeric SMILES

CC(C)C1=NC2=CC=CC=C2C(=C1)C(=O)NCCCN3CCCCCC3=O

InChI

InChI=1S/C22H29N3O2/c1-16(2)20-15-18(17-9-5-6-10-19(17)24-20)22(27)23-12-8-14-25-13-7-3-4-11-21(25)26/h5-6,9-10,15-16H,3-4,7-8,11-14H2,1-2H3,(H,23,27)