2-[4-[bis(4-propylphenyl)methylamino]phenyl]carbonyl-2-(1H-indol-3-yl)butanoic acid

Systemtic Name: 2-[4-[bis(4-propylphenyl)methylamino]phenyl]carbonyl-2-(1H-indol-3-yl)butanoic acid Openeye Name: 2-[4-[bis(4-propylphenyl)methylamino]benzoyl]-2-(1H-indol-3-yl)butanoic acid CAS Name: 2-[[4-[bis(4-propylphenyl)methylamino]phenyl]-oxomethyl]-2-(1H-indol-3-yl)butanoic acid IUPAC Name: 2-[4-[bis(4-propylphenyl)methylamino]benzoyl]-2-(1H-indol-3-yl)butanoic acid Traditional Name: 2-[4-[bis(4-propylphenyl)methylamino]benzoyl]-2-(1H-indol-3-yl)butyric acid Formula: C38H40N2O3 MolecularWeight: 572.7358

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC=C(C=C1)C(C2=CC=C(C=C2)CCC)NC3=CC=C(C=C3)C(=O)C(CC)(C4=CNC5=CC=CC=C54)C(=O)O

Isomeric SMILES

CCCC1=CC=C(C=C1)C(C2=CC=C(C=C2)CCC)NC3=CC=C(C=C3)C(=O)C(CC)(C4=CNC5=CC=CC=C54)C(=O)O

InChI

InChI=1S/C38H40N2O3/c1-4-9-26-13-17-28(18-14-26)35(29-19-15-27(10-5-2)16-20-29)40-31-23-21-30(22-24-31)36(41)38(6-3,37(42)43)33-25-39-34-12-8-7-11-32(33)34/h7-8,11-25,35,39-40H,4-6,9-10H2,1-3H3,(H,42,43)