azepan-1-yl-[5-[4-(2-hydroxyphenyl)piperazin-1-yl]-1-methyl-4,5,6,7-tetrahydroindazol-3-yl]methanone

Systemtic Name: azepan-1-yl-[5-[4-(2-hydroxyphenyl)piperazin-1-yl]-1-methyl-4,5,6,7-tetrahydroindazol-3-yl]methanone Openeye Name: azepan-1-yl-[5-[4-(2-hydroxyphenyl)piperazin-1-yl]-1-methyl-4,5,6,7-tetrahydroindazol-3-yl]methanone CAS Name: 1-azepanyl-[5-[4-(2-hydroxyphenyl)-1-piperazinyl]-1-methyl-4,5,6,7-tetrahydroindazol-3-yl]methanone IUPAC Name: azepan-1-yl-[5-[4-(2-hydroxyphenyl)piperazin-1-yl]-1-methyl-4,5,6,7-tetrahydroindazol-3-yl]methanone Traditional Name: azepan-1-yl-[5-[4-(2-hydroxyphenyl)piperazino]-1-methyl-4,5,6,7-tetrahydroindazol-3-yl]methanone Formula: C25H35N5O2 MolecularWeight: 437.5777

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(CC(CC2)N3CCN(CC3)C4=CC=CC=C4O)C(=N1)C(=O)N5CCCCCC5

Isomeric SMILES

CN1C2=C(CC(CC2)N3CCN(CC3)C4=CC=CC=C4O)C(=N1)C(=O)N5CCCCCC5

InChI

InChI=1S/C25H35N5O2/c1-27-21-11-10-19(28-14-16-29(17-15-28)22-8-4-5-9-23(22)31)18-20(21)24(26-27)25(32)30-12-6-2-3-7-13-30/h4-5,8-9,19,31H,2-3,6-7,10-18H2,1H3