N-[1-[6-chloranyl-1-(phenylmethyl)indazol-3-yl]oxybutan-2-yl]-N-hexyl-hexan-1-amine

Systemtic Name: N-[1-[6-chloranyl-1-(phenylmethyl)indazol-3-yl]oxybutan-2-yl]-N-hexyl-hexan-1-amine Openeye Name: N-[1-[(1-benzyl-6-chloro-indazol-3-yl)oxymethyl]propyl]-N-hexyl-hexan-1-amine CAS Name: N-[1-[[6-chloro-1-(phenylmethyl)-3-indazolyl]oxy]butan-2-yl]-N-hexyl-1-hexanamine IUPAC Name: N-[1-(1-benzyl-6-chloroindazol-3-yl)oxybutan-2-yl]-N-hexylhexan-1-amine Traditional Name: 1-[(1-benzyl-6-chloro-indazol-3-yl)oxymethyl]propyl-dihexyl-amine Formula: C30H44ClN3O MolecularWeight: 498.14286

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCN(CCCCCC)C(CC)COC1=NN(C2=C1C=CC(=C2)Cl)CC3=CC=CC=C3

Isomeric SMILES

CCCCCCN(CCCCCC)C(CC)COC1=NN(C2=C1C=CC(=C2)Cl)CC3=CC=CC=C3

InChI

InChI=1S/C30H44ClN3O/c1-4-7-9-14-20-33(21-15-10-8-5-2)27(6-3)24-35-30-28-19-18-26(31)22-29(28)34(32-30)23-25-16-12-11-13-17-25/h11-13,16-19,22,27H,4-10,14-15,20-21,23-24H2,1-3H3