2,4-bis[(4-naphthalen-2-yloxyphenyl)methyl-propyl-carbamoyl]cyclobutane-1,3-dicarboxylic acid

Systemtic Name: 2,4-bis[(4-naphthalen-2-yloxyphenyl)methyl-propyl-carbamoyl]cyclobutane-1,3-dicarboxylic acid Openeye Name: 2,4-bis[[4-(2-naphthyloxy)phenyl]methyl-propyl-carbamoyl]cyclobutane-1,3-dicarboxylic acid CAS Name: 2,4-bis[[[4-(2-naphthalenyloxy)phenyl]methyl-propylamino]-oxomethyl]cyclobutane-1,3-dicarboxylic acid IUPAC Name: 2,4-bis[(4-naphthalen-2-yloxyphenyl)methyl-propylcarbamoyl]cyclobutane-1,3-dicarboxylic acid Traditional Name: 2,4-bis[[4-(2-naphthoxy)benzyl]-propyl-carbamoyl]cyclobutane-1,3-dicarboxylic acid Formula: C48H46N2O8 MolecularWeight: 778.88744

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Descriptors Computed from Structure

Canonical SMILES:

CCCN(CC1=CC=C(C=C1)OC2=CC3=CC=CC=C3C=C2)C(=O)C4C(C(C4C(=O)O)C(=O)N(CCC)CC5=CC=C(C=C5)OC6=CC7=CC=CC=C7C=C6)C(=O)O

Isomeric SMILES

CCCN(CC1=CC=C(C=C1)OC2=CC3=CC=CC=C3C=C2)C(=O)C4C(C(C4C(=O)O)C(=O)N(CCC)CC5=CC=C(C=C5)OC6=CC7=CC=CC=C7C=C6)C(=O)O

InChI

InChI=1S/C48H46N2O8/c1-3-25-49(29-31-13-19-37(20-14-31)57-39-23-17-33-9-5-7-11-35(33)27-39)45(51)41-43(47(53)54)42(44(41)48(55)56)46(52)50(26-4-2)30-32-15-21-38(22-16-32)58-40-24-18-34-10-6-8-12-36(34)28-40/h5-24,27-28,41-44H,3-4,25-26,29-30H2,1-2H3,(H,53,54)(H,55,56)