N-(1-adamantylmethyl)-1-[(4-methoxyphenyl)methyl]indazol-5-amine

Systemtic Name: N-(1-adamantylmethyl)-1-[(4-methoxyphenyl)methyl]indazol-5-amine Openeye Name: N-(1-adamantylmethyl)-1-[(4-methoxyphenyl)methyl]indazol-5-amine CAS Name: N-(1-adamantylmethyl)-1-[(4-methoxyphenyl)methyl]-5-indazolamine IUPAC Name: N-(1-adamantylmethyl)-1-[(4-methoxyphenyl)methyl]indazol-5-amine Traditional Name: 1-adamantylmethyl-(1-p-anisylindazol-5-yl)amine Formula: C26H31N3O MolecularWeight: 401.54384

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CN2C3=C(C=C(C=C3)NCC45CC6CC(C4)CC(C6)C5)C=N2

Isomeric SMILES

COC1=CC=C(C=C1)CN2C3=C(C=C(C=C3)NCC45CC6CC(C4)CC(C6)C5)C=N2

InChI

InChI=1S/C26H31N3O/c1-30-24-5-2-18(3-6-24)16-29-25-7-4-23(11-22(25)15-28-29)27-17-26-12-19-8-20(13-26)10-21(9-19)14-26/h2-7,11,15,19-21,27H,8-10,12-14,16-17H2,1H3