2-[2-(3,5-dimethylphenyl)-5-morpholin-4-ylcarbonyl-1H-indol-3-yl]ethyl-(4-pyridin-4-ylbutyl)carbamic acid

Systemtic Name: 2-[2-(3,5-dimethylphenyl)-5-morpholin-4-ylcarbonyl-1H-indol-3-yl]ethyl-(4-pyridin-4-ylbutyl)carbamic acid Openeye Name: 2-[2-(3,5-dimethylphenyl)-5-(morpholine-4-carbonyl)-1H-indol-3-yl]ethyl-[4-(4-pyridyl)butyl]carbamic acid CAS Name: 2-[2-(3,5-dimethylphenyl)-5-[4-morpholinyl(oxo)methyl]-1H-indol-3-yl]ethyl-(4-pyridin-4-ylbutyl)carbamic acid IUPAC Name: 2-[2-(3,5-dimethylphenyl)-5-(morpholine-4-carbonyl)-1H-indol-3-yl]ethyl-(4-pyridin-4-ylbutyl)carbamic acid Traditional Name: 2-[2-(3,5-dimethylphenyl)-5-(morpholine-4-carbonyl)-1H-indol-3-yl]ethyl-[4-(4-pyridyl)butyl]carbamic acid Formula: C33H38N4O4 MolecularWeight: 554.67922

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)C2=C(C3=C(N2)C=CC(=C3)C(=O)N4CCOCC4)CCN(CCCCC5=CC=NC=C5)C(=O)O)C

Isomeric SMILES

CC1=CC(=CC(=C1)C2=C(C3=C(N2)C=CC(=C3)C(=O)N4CCOCC4)CCN(CCCCC5=CC=NC=C5)C(=O)O)C

InChI

InChI=1S/C33H38N4O4/c1-23-19-24(2)21-27(20-23)31-28(10-14-37(33(39)40)13-4-3-5-25-8-11-34-12-9-25)29-22-26(6-7-30(29)35-31)32(38)36-15-17-41-18-16-36/h6-9,11-12,19-22,35H,3-5,10,13-18H2,1-2H3,(H,39,40)