5-(1-tert-butyl-1,2,4-triazol-3-yl)-N-cyclopentyl-1-(oxan-2-yl)-3-phenyl-indazol-1-ium-1-carboxamide

Systemtic Name: 5-(1-tert-butyl-1,2,4-triazol-3-yl)-N-cyclopentyl-1-(oxan-2-yl)-3-phenyl-indazol-1-ium-1-carboxamide Openeye Name: 5-(1-tert-butyl-1,2,4-triazol-3-yl)-N-cyclopentyl-3-phenyl-1-tetrahydropyran-2-yl-indazol-1-ium-1-carboxamide CAS Name: 5-(1-tert-butyl-1,2,4-triazol-3-yl)-N-cyclopentyl-1-(2-oxanyl)-3-phenyl-1-indazol-1-iumcarboxamide IUPAC Name: 5-(1-tert-butyl-1,2,4-triazol-3-yl)-N-cyclopentyl-1-(oxan-2-yl)-3-phenylindazol-1-ium-1-carboxamide Traditional Name: 5-(1-tert-butyl-1,2,4-triazol-3-yl)-N-cyclopentyl-3-phenyl-1-tetrahydropyran-2-yl-indazol-1-ium-1-carboxamide Formula: C30H37N6O2+ MolecularWeight: 513.65378

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)N1C=NC(=N1)C2=CC3=C(C=C2)[N+](N=C3C4=CC=CC=C4)(C5CCCCO5)C(=O)NC6CCCC6

Isomeric SMILES

CC(C)(C)N1C=NC(=N1)C2=CC3=C(C=C2)[N+](N=C3C4=CC=CC=C4)(C5CCCCO5)C(=O)NC6CCCC6

InChI

InChI=1S/C30H36N6O2/c1-30(2,3)35-20-31-28(33-35)22-16-17-25-24(19-22)27(21-11-5-4-6-12-21)34-36(25,26-15-9-10-18-38-26)29(37)32-23-13-7-8-14-23/h4-6,11-12,16-17,19-20,23,26H,7-10,13-15,18H2,1-3H3/p+1