[3-[4-[2-(azepan-1-yl)ethoxy]phenyl]-5-butoxy-1H-inden-2-yl]-phenyl-methanone

Systemtic Name: [3-[4-[2-(azepan-1-yl)ethoxy]phenyl]-5-butoxy-1H-inden-2-yl]-phenyl-methanone Openeye Name: [3-[4-[2-(azepan-1-yl)ethoxy]phenyl]-5-butoxy-1H-inden-2-yl]-phenyl-methanone CAS Name: [3-[4-[2-(1-azepanyl)ethoxy]phenyl]-5-butoxy-1H-inden-2-yl]-phenylmethanone IUPAC Name: [3-[4-[2-(azepan-1-yl)ethoxy]phenyl]-5-butoxy-1H-inden-2-yl]-phenylmethanone Traditional Name: [3-[4-[2-(azepan-1-yl)ethoxy]phenyl]-5-butoxy-1H-inden-2-yl]-phenyl-methanone Formula: C34H39NO3 MolecularWeight: 509.67836

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC2=C(CC(=C2C3=CC=C(C=C3)OCCN4CCCCCC4)C(=O)C5=CC=CC=C5)C=C1

Isomeric SMILES

CCCCOC1=CC2=C(CC(=C2C3=CC=C(C=C3)OCCN4CCCCCC4)C(=O)C5=CC=CC=C5)C=C1

InChI

InChI=1S/C34H39NO3/c1-2-3-22-37-30-18-15-28-24-32(34(36)27-11-7-6-8-12-27)33(31(28)25-30)26-13-16-29(17-14-26)38-23-21-35-19-9-4-5-10-20-35/h6-8,11-18,25H,2-5,9-10,19-24H2,1H3