[4-(furan-2-ylmethyl)-1,4-diazepan-1-yl]-(2-phenylquinolin-4-yl)methanone

Systemtic Name: [4-(furan-2-ylmethyl)-1,4-diazepan-1-yl]-(2-phenylquinolin-4-yl)methanone Openeye Name: [4-(2-furylmethyl)-1,4-diazepan-1-yl]-(2-phenyl-4-quinolyl)methanone CAS Name: [4-(2-furanylmethyl)-1,4-diazepan-1-yl]-(2-phenyl-4-quinolinyl)methanone IUPAC Name: [4-(furan-2-ylmethyl)-1,4-diazepan-1-yl]-(2-phenylquinolin-4-yl)methanone Traditional Name: [4-(2-furfuryl)-1,4-diazepan-1-yl]-(2-phenyl-4-quinolyl)methanone Formula: C26H25N3O2 MolecularWeight: 411.4956

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN(C1)C(=O)C2=CC(=NC3=CC=CC=C32)C4=CC=CC=C4)CC5=CC=CO5

Isomeric SMILES

C1CN(CCN(C1)C(=O)C2=CC(=NC3=CC=CC=C32)C4=CC=CC=C4)CC5=CC=CO5

InChI

InChI=1S/C26H25N3O2/c30-26(29-14-7-13-28(15-16-29)19-21-10-6-17-31-21)23-18-25(20-8-2-1-3-9-20)27-24-12-5-4-11-22(23)24/h1-6,8-12,17-18H,7,13-16,19H2