(3-phenethyloxyphenyl)-[4-(3-phenethyloxyphenyl)carbonyl-1,4-diazepan-1-yl]methanone

Systemtic Name: (3-phenethyloxyphenyl)-[4-(3-phenethyloxyphenyl)carbonyl-1,4-diazepan-1-yl]methanone Openeye Name: [4-(3-phenethyloxybenzoyl)-1,4-diazepan-1-yl]-(3-phenethyloxyphenyl)methanone CAS Name: [4-[oxo-(3-phenethyloxyphenyl)methyl]-1,4-diazepan-1-yl]-(3-phenethyloxyphenyl)methanone IUPAC Name: [4-(3-phenethyloxybenzoyl)-1,4-diazepan-1-yl]-(3-phenethyloxyphenyl)methanone Traditional Name: [4-(3-phenethyloxybenzoyl)-1,4-diazepan-1-yl]-(3-phenethyloxyphenyl)methanone Formula: C35H36N2O4 MolecularWeight: 548.67134

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN(C1)C(=O)C2=CC(=CC=C2)OCCC3=CC=CC=C3)C(=O)C4=CC(=CC=C4)OCCC5=CC=CC=C5

Isomeric SMILES

C1CN(CCN(C1)C(=O)C2=CC(=CC=C2)OCCC3=CC=CC=C3)C(=O)C4=CC(=CC=C4)OCCC5=CC=CC=C5

InChI

InChI=1S/C35H36N2O4/c38-34(30-14-7-16-32(26-30)40-24-18-28-10-3-1-4-11-28)36-20-9-21-37(23-22-36)35(39)31-15-8-17-33(27-31)41-25-19-29-12-5-2-6-13-29/h1-8,10-17,26-27H,9,18-25H2