tert-butyl N-[4-[(5-bromanyl-2-methoxy-phenyl)methyl-methyl-carbamoyl]phenyl]carbamate

Systemtic Name: tert-butyl N-[4-[(5-bromanyl-2-methoxy-phenyl)methyl-methyl-carbamoyl]phenyl]carbamate Openeye Name: tert-butyl N-[4-[(5-bromo-2-methoxy-phenyl)methyl-methyl-carbamoyl]phenyl]carbamate CAS Name: N-[4-[[(5-bromo-2-methoxyphenyl)methyl-methylamino]-oxomethyl]phenyl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[4-[(5-bromo-2-methoxyphenyl)methyl-methylcarbamoyl]phenyl]carbamate Traditional Name: N-[4-[(5-bromo-2-methoxy-benzyl)-methyl-carbamoyl]phenyl]carbamic acid tert-butyl ester Formula: C21H25BrN2O4 MolecularWeight: 449.3382

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC1=CC=C(C=C1)C(=O)N(C)CC2=C(C=CC(=C2)Br)OC

Isomeric SMILES

CC(C)(C)OC(=O)NC1=CC=C(C=C1)C(=O)N(C)CC2=C(C=CC(=C2)Br)OC

InChI

InChI=1S/C21H25BrN2O4/c1-21(2,3)28-20(26)23-17-9-6-14(7-10-17)19(25)24(4)13-15-12-16(22)8-11-18(15)27-5/h6-12H,13H2,1-5H3,(H,23,26)