[2-azanyl-3-bromanyl-5-methyl-4-[3-[methyl(phenyl)amino]-3-oxidanylidene-propyl]phenyl] prop-2-enyl carbonate

Systemtic Name: [2-azanyl-3-bromanyl-5-methyl-4-[3-[methyl(phenyl)amino]-3-oxidanylidene-propyl]phenyl] prop-2-enyl carbonate Openeye Name: allyl [2-amino-3-bromo-5-methyl-4-[3-(N-methylanilino)-3-oxo-propyl]phenyl] carbonate CAS Name: carbonic acid [2-amino-3-bromo-5-methyl-4-[3-(N-methylanilino)-3-oxopropyl]phenyl] prop-2-enyl ester IUPAC Name: [2-amino-3-bromo-5-methyl-4-[3-(N-methylanilino)-3-oxopropyl]phenyl] prop-2-enyl carbonate Traditional Name: carbonic acid allyl [2-amino-3-bromo-4-[3-keto-3-(N-methylanilino)propyl]-5-methyl-phenyl] ester Formula: C21H23BrN2O4 MolecularWeight: 447.32232

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1CCC(=O)N(C)C2=CC=CC=C2)Br)N)OC(=O)OCC=C

Isomeric SMILES

CC1=CC(=C(C(=C1CCC(=O)N(C)C2=CC=CC=C2)Br)N)OC(=O)OCC=C

InChI

InChI=1S/C21H23BrN2O4/c1-4-12-27-21(26)28-17-13-14(2)16(19(22)20(17)23)10-11-18(25)24(3)15-8-6-5-7-9-15/h4-9,13H,1,10-12,23H2,2-3H3