1-cyclohexa-1,5-dien-1-yl-2-[5-(4-phenylbutoxy)pentyl-(phenylmethyl)amino]ethanone

Systemtic Name: 1-cyclohexa-1,5-dien-1-yl-2-[5-(4-phenylbutoxy)pentyl-(phenylmethyl)amino]ethanone Openeye Name: 2-[benzyl-[5-(4-phenylbutoxy)pentyl]amino]-1-cyclohexa-1,5-dien-1-yl-ethanone CAS Name: 1-(1-cyclohexa-1,5-dienyl)-2-[5-(4-phenylbutoxy)pentyl-(phenylmethyl)amino]ethanone IUPAC Name: 2-[benzyl-[5-(4-phenylbutoxy)pentyl]amino]-1-cyclohexa-1,5-dien-1-ylethanone Traditional Name: 2-[benzyl-[5-(4-phenylbutoxy)pentyl]amino]-1-cyclohexa-1,5-dien-1-yl-ethanone Formula: C30H39NO2 MolecularWeight: 445.63616

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Descriptors Computed from Structure

Canonical SMILES:

C1CC=C(C=C1)C(=O)CN(CCCCCOCCCCC2=CC=CC=C2)CC3=CC=CC=C3

Isomeric SMILES

C1CC=C(C=C1)C(=O)CN(CCCCCOCCCCC2=CC=CC=C2)CC3=CC=CC=C3

InChI

InChI=1S/C30H39NO2/c32-30(29-20-9-3-10-21-29)26-31(25-28-18-7-2-8-19-28)22-12-4-13-23-33-24-14-11-17-27-15-5-1-6-16-27/h1-2,5-9,15-16,18-21H,3-4,10-14,17,22-26H2