1-(azepan-1-yl)-2-(5-chloranyl-3-phenyl-indazol-1-yl)butan-1-one

Systemtic Name: 1-(azepan-1-yl)-2-(5-chloranyl-3-phenyl-indazol-1-yl)butan-1-one Openeye Name: 1-(azepan-1-yl)-2-(5-chloro-3-phenyl-indazol-1-yl)butan-1-one CAS Name: 1-(1-azepanyl)-2-(5-chloro-3-phenyl-1-indazolyl)-1-butanone IUPAC Name: 1-(azepan-1-yl)-2-(5-chloro-3-phenylindazol-1-yl)butan-1-one Traditional Name: 1-(azepan-1-yl)-2-(5-chloro-3-phenyl-indazol-1-yl)butan-1-one Formula: C23H26ClN3O MolecularWeight: 395.92504

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)N1CCCCCC1)N2C3=C(C=C(C=C3)Cl)C(=N2)C4=CC=CC=C4

Isomeric SMILES

CCC(C(=O)N1CCCCCC1)N2C3=C(C=C(C=C3)Cl)C(=N2)C4=CC=CC=C4

InChI

InChI=1S/C23H26ClN3O/c1-2-20(23(28)26-14-8-3-4-9-15-26)27-21-13-12-18(24)16-19(21)22(25-27)17-10-6-5-7-11-17/h5-7,10-13,16,20H,2-4,8-9,14-15H2,1H3