1-[4-(azepan-1-ylcarbonyl)phenyl]-3-methyl-6,7-dihydro-5H-indazol-4-one

Systemtic Name: 1-[4-(azepan-1-ylcarbonyl)phenyl]-3-methyl-6,7-dihydro-5H-indazol-4-one Openeye Name: 1-[4-(azepane-1-carbonyl)phenyl]-3-methyl-6,7-dihydro-5H-indazol-4-one CAS Name: 1-[4-[1-azepanyl(oxo)methyl]phenyl]-3-methyl-6,7-dihydro-5H-indazol-4-one IUPAC Name: 1-[4-(azepane-1-carbonyl)phenyl]-3-methyl-6,7-dihydro-5H-indazol-4-one Traditional Name: 1-[4-(azepane-1-carbonyl)phenyl]-3-methyl-6,7-dihydro-5H-indazol-4-one Formula: C21H25N3O2 MolecularWeight: 351.4421

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C2=C1C(=O)CCC2)C3=CC=C(C=C3)C(=O)N4CCCCCC4

Isomeric SMILES

CC1=NN(C2=C1C(=O)CCC2)C3=CC=C(C=C3)C(=O)N4CCCCCC4

InChI

InChI=1S/C21H25N3O2/c1-15-20-18(7-6-8-19(20)25)24(22-15)17-11-9-16(10-12-17)21(26)23-13-4-2-3-5-14-23/h9-12H,2-8,13-14H2,1H3