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

Systemtic Name: azepan-1-yl-[5-[(2,3-dimethoxyphenyl)methylamino]-1-ethyl-4,5,6,7-tetrahydroindazol-3-yl]methanone Openeye Name: azepan-1-yl-[5-[(2,3-dimethoxyphenyl)methylamino]-1-ethyl-4,5,6,7-tetrahydroindazol-3-yl]methanone CAS Name: 1-azepanyl-[5-[(2,3-dimethoxyphenyl)methylamino]-1-ethyl-4,5,6,7-tetrahydroindazol-3-yl]methanone IUPAC Name: azepan-1-yl-[5-[(2,3-dimethoxyphenyl)methylamino]-1-ethyl-4,5,6,7-tetrahydroindazol-3-yl]methanone Traditional Name: azepan-1-yl-[1-ethyl-5-(o-veratrylamino)-4,5,6,7-tetrahydroindazol-3-yl]methanone Formula: C25H36N4O3 MolecularWeight: 440.57834

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(CC(CC2)NCC3=C(C(=CC=C3)OC)OC)C(=N1)C(=O)N4CCCCCC4

Isomeric SMILES

CCN1C2=C(CC(CC2)NCC3=C(C(=CC=C3)OC)OC)C(=N1)C(=O)N4CCCCCC4

InChI

InChI=1S/C25H36N4O3/c1-4-29-21-13-12-19(26-17-18-10-9-11-22(31-2)24(18)32-3)16-20(21)23(27-29)25(30)28-14-7-5-6-8-15-28/h9-11,19,26H,4-8,12-17H2,1-3H3