2-[1-[2-(azepan-1-yl)-2-oxidanylidene-ethyl]indol-3-yl]-N-(4-butylphenyl)-2-oxidanylidene-ethanamide

Systemtic Name: 2-[1-[2-(azepan-1-yl)-2-oxidanylidene-ethyl]indol-3-yl]-N-(4-butylphenyl)-2-oxidanylidene-ethanamide Openeye Name: 2-[1-[2-(azepan-1-yl)-2-oxo-ethyl]indol-3-yl]-N-(4-butylphenyl)-2-oxo-acetamide CAS Name: 2-[1-[2-(1-azepanyl)-2-oxoethyl]-3-indolyl]-N-(4-butylphenyl)-2-oxoacetamide IUPAC Name: 2-[1-[2-(azepan-1-yl)-2-oxoethyl]indol-3-yl]-N-(4-butylphenyl)-2-oxoacetamide Traditional Name: 2-[1-[2-(azepan-1-yl)-2-keto-ethyl]indol-3-yl]-N-(4-butylphenyl)-2-keto-acetamide Formula: C28H33N3O3 MolecularWeight: 459.57992

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)NC(=O)C(=O)C2=CN(C3=CC=CC=C32)CC(=O)N4CCCCCC4

Isomeric SMILES

CCCCC1=CC=C(C=C1)NC(=O)C(=O)C2=CN(C3=CC=CC=C32)CC(=O)N4CCCCCC4

InChI

InChI=1S/C28H33N3O3/c1-2-3-10-21-13-15-22(16-14-21)29-28(34)27(33)24-19-31(25-12-7-6-11-23(24)25)20-26(32)30-17-8-4-5-9-18-30/h6-7,11-16,19H,2-5,8-10,17-18,20H2,1H3,(H,29,34)