1-[3-(4-chloranyl-2,3-dimethyl-phenoxy)-4-(methylaminomethyl)phenyl]-3-phenyl-prop-2-yn-1-ol

Systemtic Name: 1-[3-(4-chloranyl-2,3-dimethyl-phenoxy)-4-(methylaminomethyl)phenyl]-3-phenyl-prop-2-yn-1-ol Openeye Name: 1-[3-(4-chloro-2,3-dimethyl-phenoxy)-4-(methylaminomethyl)phenyl]-3-phenyl-prop-2-yn-1-ol CAS Name: 1-[3-(4-chloro-2,3-dimethylphenoxy)-4-(methylaminomethyl)phenyl]-3-phenyl-2-propyn-1-ol IUPAC Name: 1-[3-(4-chloro-2,3-dimethylphenoxy)-4-(methylaminomethyl)phenyl]-3-phenylprop-2-yn-1-ol Traditional Name: 1-[3-(4-chloro-2,3-dimethyl-phenoxy)-4-(methylaminomethyl)phenyl]-3-phenyl-prop-2-yn-1-ol Formula: C25H24ClNO2 MolecularWeight: 405.91656

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1C)Cl)OC2=C(C=CC(=C2)C(C#CC3=CC=CC=C3)O)CNC

Isomeric SMILES

CC1=C(C=CC(=C1C)Cl)OC2=C(C=CC(=C2)C(C#CC3=CC=CC=C3)O)CNC

InChI

InChI=1S/C25H24ClNO2/c1-17-18(2)24(14-12-22(17)26)29-25-15-20(10-11-21(25)16-27-3)23(28)13-9-19-7-5-4-6-8-19/h4-8,10-12,14-15,23,27-28H,16H2,1-3H3