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

Systemtic Name: 5-chloranyl-N-[(3-ethoxy-5-iodanyl-4-prop-2-ynoxy-phenyl)methyl]-2-methyl-aniline Openeye Name: 5-chloro-N-[(3-ethoxy-5-iodo-4-prop-2-ynoxy-phenyl)methyl]-2-methyl-aniline CAS Name: 5-chloro-N-[(3-ethoxy-5-iodo-4-prop-2-ynoxyphenyl)methyl]-2-methylaniline IUPAC Name: 5-chloro-N-[(3-ethoxy-5-iodo-4-prop-2-ynoxyphenyl)methyl]-2-methylaniline Traditional Name: (5-chloro-2-methyl-phenyl)-(3-ethoxy-5-iodo-4-propargyloxy-benzyl)amine Formula: C19H19ClINO2 MolecularWeight: 455.71713

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C(=CC(=C1)CNC2=C(C=CC(=C2)Cl)C)I)OCC#C

Isomeric SMILES

CCOC1=C(C(=CC(=C1)CNC2=C(C=CC(=C2)Cl)C)I)OCC#C

InChI

InChI=1S/C19H19ClINO2/c1-4-8-24-19-16(21)9-14(10-18(19)23-5-2)12-22-17-11-15(20)7-6-13(17)3/h1,6-7,9-11,22H,5,8,12H2,2-3H3