N-[3-(2-bromophenyl)-1-diethoxyphosphoryl-prop-2-ynyl]-4-methoxy-aniline

Systemtic Name: N-[3-(2-bromophenyl)-1-diethoxyphosphoryl-prop-2-ynyl]-4-methoxy-aniline Openeye Name: N-[3-(2-bromophenyl)-1-diethoxyphosphoryl-prop-2-ynyl]-4-methoxy-aniline CAS Name: N-[3-(2-bromophenyl)-1-diethoxyphosphorylprop-2-ynyl]-4-methoxyaniline IUPAC Name: N-[3-(2-bromophenyl)-1-diethoxyphosphorylprop-2-ynyl]-4-methoxyaniline Traditional Name: [3-(2-bromophenyl)-1-diethoxyphosphoryl-prop-2-ynyl]-(4-methoxyphenyl)amine Formula: C20H23BrNO4P MolecularWeight: 452.278681

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Descriptors Computed from Structure

Canonical SMILES:

CCOP(=O)(C(C#CC1=CC=CC=C1Br)NC2=CC=C(C=C2)OC)OCC

Isomeric SMILES

CCOP(=O)(C(C#CC1=CC=CC=C1Br)NC2=CC=C(C=C2)OC)OCC

InChI

InChI=1S/C20H23BrNO4P/c1-4-25-27(23,26-5-2)20(15-10-16-8-6-7-9-19(16)21)22-17-11-13-18(24-3)14-12-17/h6-9,11-14,20,22H,4-5H2,1-3H3