aniline; [2-butyl-5-chloranyl-3-(phenylmethyl)imidazol-4-yl]methanol

Systemtic Name: aniline; [2-butyl-5-chloranyl-3-(phenylmethyl)imidazol-4-yl]methanol Openeye Name: aniline; (3-benzyl-2-butyl-5-chloro-imidazol-4-yl)methanol CAS Name: aniline; [2-butyl-5-chloro-3-(phenylmethyl)-4-imidazolyl]methanol IUPAC Name: aniline; (3-benzyl-2-butyl-5-chloroimidazol-4-yl)methanol Traditional Name: (3-benzyl-2-butyl-5-chloro-imidazol-4-yl)methanol; phenylamine Formula: C21H26ClN3O MolecularWeight: 371.90364

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=NC(=C(N1CC2=CC=CC=C2)CO)Cl.C1=CC=C(C=C1)N

Isomeric SMILES

CCCCC1=NC(=C(N1CC2=CC=CC=C2)CO)Cl.C1=CC=C(C=C1)N

InChI

InChI=1S/C15H19ClN2O.C6H7N/c1-2-3-9-14-17-15(16)13(11-19)18(14)10-12-7-5-4-6-8-12;7-6-4-2-1-3-5-6/h4-8,19H,2-3,9-11H2,1H3;1-5H,7H2