indol-1-yl 2-[bis[4-(2-methylpropyl)phenyl]methylamino]-2-(phenylcarbonyl)butanoate

Systemtic Name: indol-1-yl 2-[bis[4-(2-methylpropyl)phenyl]methylamino]-2-(phenylcarbonyl)butanoate Openeye Name: indol-1-yl 2-benzoyl-2-[bis(4-isobutylphenyl)methylamino]butanoate CAS Name: 2-benzoyl-2-[bis[4-(2-methylpropyl)phenyl]methylamino]butanoic acid 1-indolyl ester IUPAC Name: indol-1-yl 2-benzoyl-2-[bis[4-(2-methylpropyl)phenyl]methylamino]butanoate Traditional Name: 2-benzoyl-2-[bis(4-isobutylphenyl)methylamino]butyric acid indol-1-yl ester Formula: C40H44N2O3 MolecularWeight: 600.78896

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)C1=CC=CC=C1)(C(=O)ON2C=CC3=CC=CC=C32)NC(C4=CC=C(C=C4)CC(C)C)C5=CC=C(C=C5)CC(C)C

Isomeric SMILES

CCC(C(=O)C1=CC=CC=C1)(C(=O)ON2C=CC3=CC=CC=C32)NC(C4=CC=C(C=C4)CC(C)C)C5=CC=C(C=C5)CC(C)C

InChI

InChI=1S/C40H44N2O3/c1-6-40(38(43)35-13-8-7-9-14-35,39(44)45-42-25-24-32-12-10-11-15-36(32)42)41-37(33-20-16-30(17-21-33)26-28(2)3)34-22-18-31(19-23-34)27-29(4)5/h7-25,28-29,37,41H,6,26-27H2,1-5H3