1-acetyloxyethyl 2-[2-[2-(5-bromanyl-2-methoxy-phenyl)ethyl]-3-chloranyl-phenyl]-5,6-dihydro-4H-pyrimidine-1-carboxylate

Systemtic Name: 1-acetyloxyethyl 2-[2-[2-(5-bromanyl-2-methoxy-phenyl)ethyl]-3-chloranyl-phenyl]-5,6-dihydro-4H-pyrimidine-1-carboxylate Openeye Name: 1-acetoxyethyl 2-[2-[2-(5-bromo-2-methoxy-phenyl)ethyl]-3-chloro-phenyl]-5,6-dihydro-4H-pyrimidine-1-carboxylate CAS Name: 2-[2-[2-(5-bromo-2-methoxyphenyl)ethyl]-3-chlorophenyl]-5,6-dihydro-4H-pyrimidine-1-carboxylic acid 1-acetyloxyethyl ester IUPAC Name: 1-acetyloxyethyl 2-[2-[2-(5-bromo-2-methoxyphenyl)ethyl]-3-chlorophenyl]-5,6-dihydro-4H-pyrimidine-1-carboxylate Traditional Name: 2-[2-[2-(5-bromo-2-methoxy-phenyl)ethyl]-3-chloro-phenyl]-5,6-dihydro-4H-pyrimidine-1-carboxylic acid 1-acetoxyethyl ester Formula: C24H26BrClN2O5 MolecularWeight: 537.83064

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Descriptors Computed from Structure

Canonical SMILES:

CC(OC(=O)C)OC(=O)N1CCCN=C1C2=C(C(=CC=C2)Cl)CCC3=C(C=CC(=C3)Br)OC

Isomeric SMILES

CC(OC(=O)C)OC(=O)N1CCCN=C1C2=C(C(=CC=C2)Cl)CCC3=C(C=CC(=C3)Br)OC

InChI

InChI=1S/C24H26BrClN2O5/c1-15(29)32-16(2)33-24(30)28-13-5-12-27-23(28)20-6-4-7-21(26)19(20)10-8-17-14-18(25)9-11-22(17)31-3/h4,6-7,9,11,14,16H,5,8,10,12-13H2,1-3H3