4,4-bis[4-[(4-bromophenyl)carbamoyloxy]phenyl]pentanoic acid

Systemtic Name: 4,4-bis[4-[(4-bromophenyl)carbamoyloxy]phenyl]pentanoic acid Openeye Name: 4,4-bis[4-[(4-bromophenyl)carbamoyloxy]phenyl]pentanoic acid CAS Name: 4,4-bis[4-[(4-bromoanilino)-oxomethoxy]phenyl]pentanoic acid IUPAC Name: 4,4-bis[4-[(4-bromophenyl)carbamoyloxy]phenyl]pentanoic acid Traditional Name: 4,4-bis[4-[(4-bromophenyl)carbamoyloxy]phenyl]valeric acid Formula: C31H26Br2N2O6 MolecularWeight: 682.35594

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCC(=O)O)(C1=CC=C(C=C1)OC(=O)NC2=CC=C(C=C2)Br)C3=CC=C(C=C3)OC(=O)NC4=CC=C(C=C4)Br

Isomeric SMILES

CC(CCC(=O)O)(C1=CC=C(C=C1)OC(=O)NC2=CC=C(C=C2)Br)C3=CC=C(C=C3)OC(=O)NC4=CC=C(C=C4)Br

InChI

InChI=1S/C31H26Br2N2O6/c1-31(19-18-28(36)37,20-2-14-26(15-3-20)40-29(38)34-24-10-6-22(32)7-11-24)21-4-16-27(17-5-21)41-30(39)35-25-12-8-23(33)9-13-25/h2-17H,18-19H2,1H3,(H,34,38)(H,35,39)(H,36,37)