methyl 2-[(4-bromophenyl)-(diphenylphosphinothioylamino)methyl]prop-2-enoate

Systemtic Name: methyl 2-[(4-bromophenyl)-(diphenylphosphinothioylamino)methyl]prop-2-enoate Openeye Name: methyl 2-[(4-bromophenyl)-(diphenylphosphinothioylamino)methyl]prop-2-enoate CAS Name: 2-[(4-bromophenyl)-(diphenylphosphinothioylamino)methyl]-2-propenoic acid methyl ester IUPAC Name: methyl 2-[(4-bromophenyl)-(diphenylphosphinothioylamino)methyl]prop-2-enoate Traditional Name: 2-[(4-bromophenyl)-(diphenylthiophosphorylamino)methyl]acrylic acid methyl ester Formula: C23H21BrNO2PS MolecularWeight: 486.361101

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(=C)C(C1=CC=C(C=C1)Br)NP(=S)(C2=CC=CC=C2)C3=CC=CC=C3

Isomeric SMILES

COC(=O)C(=C)C(C1=CC=C(C=C1)Br)NP(=S)(C2=CC=CC=C2)C3=CC=CC=C3

InChI

InChI=1S/C23H21BrNO2PS/c1-17(23(26)27-2)22(18-13-15-19(24)16-14-18)25-28(29,20-9-5-3-6-10-20)21-11-7-4-8-12-21/h3-16,22H,1H2,2H3,(H,25,29)