3-[bis[4-(2-methylpropyl)phenyl]methylamino]-2-(furan-2-ylcarbonyl)-2-indol-1-yl-butanoic acid

Systemtic Name: 3-[bis[4-(2-methylpropyl)phenyl]methylamino]-2-(furan-2-ylcarbonyl)-2-indol-1-yl-butanoic acid Openeye Name: 3-[bis(4-isobutylphenyl)methylamino]-2-(furan-2-carbonyl)-2-indol-1-yl-butanoic acid CAS Name: 3-[bis[4-(2-methylpropyl)phenyl]methylamino]-2-[2-furanyl(oxo)methyl]-2-(1-indolyl)butanoic acid IUPAC Name: 3-[bis[4-(2-methylpropyl)phenyl]methylamino]-2-(furan-2-carbonyl)-2-indol-1-ylbutanoic acid Traditional Name: 3-[bis(4-isobutylphenyl)methylamino]-2-(2-furoyl)-2-indol-1-yl-butyric acid Formula: C38H42N2O4 MolecularWeight: 590.75108

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC1=CC=C(C=C1)C(C2=CC=C(C=C2)CC(C)C)NC(C)C(C(=O)C3=CC=CO3)(C(=O)O)N4C=CC5=CC=CC=C54

Isomeric SMILES

CC(C)CC1=CC=C(C=C1)C(C2=CC=C(C=C2)CC(C)C)NC(C)C(C(=O)C3=CC=CO3)(C(=O)O)N4C=CC5=CC=CC=C54

InChI

InChI=1S/C38H42N2O4/c1-25(2)23-28-12-16-31(17-13-28)35(32-18-14-29(15-19-32)24-26(3)4)39-27(5)38(37(42)43,36(41)34-11-8-22-44-34)40-21-20-30-9-6-7-10-33(30)40/h6-22,25-27,35,39H,23-24H2,1-5H3,(H,42,43)