4-chloranyl-N-[(3-methoxy-4-prop-2-ynoxy-phenyl)methyl]aniline

Systemtic Name: 4-chloranyl-N-[(3-methoxy-4-prop-2-ynoxy-phenyl)methyl]aniline Openeye Name: 4-chloro-N-[(3-methoxy-4-prop-2-ynoxy-phenyl)methyl]aniline CAS Name: 4-chloro-N-[(3-methoxy-4-prop-2-ynoxyphenyl)methyl]aniline IUPAC Name: 4-chloro-N-[(3-methoxy-4-prop-2-ynoxyphenyl)methyl]aniline Traditional Name: (4-chlorophenyl)-(3-methoxy-4-propargyloxy-benzyl)amine Formula: C17H16ClNO2 MolecularWeight: 301.76744

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)CNC2=CC=C(C=C2)Cl)OCC#C

Isomeric SMILES

COC1=C(C=CC(=C1)CNC2=CC=C(C=C2)Cl)OCC#C

InChI

InChI=1S/C17H16ClNO2/c1-3-10-21-16-9-4-13(11-17(16)20-2)12-19-15-7-5-14(18)6-8-15/h1,4-9,11,19H,10,12H2,2H3