N-[(3-iodanyl-5-methoxy-4-prop-2-ynoxy-phenyl)methyl]aniline

Systemtic Name: N-[(3-iodanyl-5-methoxy-4-prop-2-ynoxy-phenyl)methyl]aniline Openeye Name: N-[(3-iodo-5-methoxy-4-prop-2-ynoxy-phenyl)methyl]aniline CAS Name: N-[(3-iodo-5-methoxy-4-prop-2-ynoxyphenyl)methyl]aniline IUPAC Name: N-[(3-iodo-5-methoxy-4-prop-2-ynoxyphenyl)methyl]aniline Traditional Name: (3-iodo-5-methoxy-4-propargyloxy-benzyl)-phenyl-amine Formula: C17H16INO2 MolecularWeight: 393.21891

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H16INO2/c1-3-9-21-17-15(18)10-13(11-16(17)20-2)12-19-14-7-5-4-6-8-14/h1,4-8,10-11,19H,9,12H2,2H3