azepan-1-yl-[1-ethyl-5-[2-(3-methoxyphenyl)ethylamino]-4,5,6,7-tetrahydroindazol-3-yl]methanone

Systemtic Name: azepan-1-yl-[1-ethyl-5-[2-(3-methoxyphenyl)ethylamino]-4,5,6,7-tetrahydroindazol-3-yl]methanone Openeye Name: azepan-1-yl-[1-ethyl-5-[2-(3-methoxyphenyl)ethylamino]-4,5,6,7-tetrahydroindazol-3-yl]methanone CAS Name: 1-azepanyl-[1-ethyl-5-[2-(3-methoxyphenyl)ethylamino]-4,5,6,7-tetrahydroindazol-3-yl]methanone IUPAC Name: azepan-1-yl-[1-ethyl-5-[2-(3-methoxyphenyl)ethylamino]-4,5,6,7-tetrahydroindazol-3-yl]methanone Traditional Name: azepan-1-yl-[1-ethyl-5-[2-(3-methoxyphenyl)ethylamino]-4,5,6,7-tetrahydroindazol-3-yl]methanone Formula: C25H36N4O2 MolecularWeight: 424.57894

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(CC(CC2)NCCC3=CC(=CC=C3)OC)C(=N1)C(=O)N4CCCCCC4

Isomeric SMILES

CCN1C2=C(CC(CC2)NCCC3=CC(=CC=C3)OC)C(=N1)C(=O)N4CCCCCC4

InChI

InChI=1S/C25H36N4O2/c1-3-29-23-12-11-20(26-14-13-19-9-8-10-21(17-19)31-2)18-22(23)24(27-29)25(30)28-15-6-4-5-7-16-28/h8-10,17,20,26H,3-7,11-16,18H2,1-2H3