(5-chloranyl-3-methyl-1-benzofuran-2-yl)-[4-(phenylmethyl)-1,4-diazepan-1-yl]methanone

Systemtic Name: (5-chloranyl-3-methyl-1-benzofuran-2-yl)-[4-(phenylmethyl)-1,4-diazepan-1-yl]methanone Openeye Name: (4-benzyl-1,4-diazepan-1-yl)-(5-chloro-3-methyl-benzofuran-2-yl)methanone CAS Name: (5-chloro-3-methyl-2-benzofuranyl)-[4-(phenylmethyl)-1,4-diazepan-1-yl]methanone IUPAC Name: (4-benzyl-1,4-diazepan-1-yl)-(5-chloro-3-methyl-1-benzofuran-2-yl)methanone Traditional Name: (4-benzyl-1,4-diazepan-1-yl)-(5-chloro-3-methyl-benzofuran-2-yl)methanone Formula: C22H23ClN2O2 MolecularWeight: 382.88322

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(OC2=C1C=C(C=C2)Cl)C(=O)N3CCCN(CC3)CC4=CC=CC=C4

Isomeric SMILES

CC1=C(OC2=C1C=C(C=C2)Cl)C(=O)N3CCCN(CC3)CC4=CC=CC=C4

InChI

InChI=1S/C22H23ClN2O2/c1-16-19-14-18(23)8-9-20(19)27-21(16)22(26)25-11-5-10-24(12-13-25)15-17-6-3-2-4-7-17/h2-4,6-9,14H,5,10-13,15H2,1H3