3-[(3-bromanyl-5-methoxy-phenyl)methyl-octan-4-yloxy-amino]cyclopentane-1,1-dicarboxylic acid

Systemtic Name: 3-[(3-bromanyl-5-methoxy-phenyl)methyl-octan-4-yloxy-amino]cyclopentane-1,1-dicarboxylic acid Openeye Name: 3-[(3-bromo-5-methoxy-phenyl)methyl-(1-propylpentoxy)amino]cyclopentane-1,1-dicarboxylic acid CAS Name: 3-[(3-bromo-5-methoxyphenyl)methyl-octan-4-yloxyamino]cyclopentane-1,1-dicarboxylic acid IUPAC Name: 3-[(3-bromo-5-methoxyphenyl)methyl-octan-4-yloxyamino]cyclopentane-1,1-dicarboxylic acid Traditional Name: 3-[(3-bromo-5-methoxy-benzyl)-(1-propylpentoxy)amino]cyclopentane-1,1-dicarboxylic acid Formula: C23H34BrNO6 MolecularWeight: 500.42316

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CCC)ON(CC1=CC(=CC(=C1)Br)OC)C2CCC(C2)(C(=O)O)C(=O)O

Isomeric SMILES

CCCCC(CCC)ON(CC1=CC(=CC(=C1)Br)OC)C2CCC(C2)(C(=O)O)C(=O)O

InChI

InChI=1S/C23H34BrNO6/c1-4-6-8-19(7-5-2)31-25(15-16-11-17(24)13-20(12-16)30-3)18-9-10-23(14-18,21(26)27)22(28)29/h11-13,18-19H,4-10,14-15H2,1-3H3,(H,26,27)(H,28,29)