methyl N-[2-[4-(1-azanyl-2-oxidanyl-hexoxy)-3-bromanyl-phenyl]ethyl]carbamate

Systemtic Name: methyl N-[2-[4-(1-azanyl-2-oxidanyl-hexoxy)-3-bromanyl-phenyl]ethyl]carbamate Openeye Name: methyl N-[2-[4-(1-amino-2-hydroxy-hexoxy)-3-bromo-phenyl]ethyl]carbamate CAS Name: N-[2-[4-(1-amino-2-hydroxyhexoxy)-3-bromophenyl]ethyl]carbamic acid methyl ester IUPAC Name: methyl N-[2-[4-(1-amino-2-hydroxyhexoxy)-3-bromophenyl]ethyl]carbamate Traditional Name: N-[2-[4-(1-amino-2-hydroxy-hexoxy)-3-bromo-phenyl]ethyl]carbamic acid methyl ester Formula: C16H25BrN2O4 MolecularWeight: 389.2847

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(C(N)OC1=C(C=C(C=C1)CCNC(=O)OC)Br)O

Isomeric SMILES

CCCCC(C(N)OC1=C(C=C(C=C1)CCNC(=O)OC)Br)O

InChI

InChI=1S/C16H25BrN2O4/c1-3-4-5-13(20)15(18)23-14-7-6-11(10-12(14)17)8-9-19-16(21)22-2/h6-7,10,13,15,20H,3-5,8-9,18H2,1-2H3,(H,19,21)