3-[3,3-diethyl-8-oxidanyl-6-(5-phenylpentoxy)-2,4-dihydro-1H-naphthalen-1-yl]-3-oxidanylidene-propanenitrile

Systemtic Name: 3-[3,3-diethyl-8-oxidanyl-6-(5-phenylpentoxy)-2,4-dihydro-1H-naphthalen-1-yl]-3-oxidanylidene-propanenitrile Openeye Name: 3-[3,3-diethyl-8-hydroxy-6-(5-phenylpentoxy)tetralin-1-yl]-3-oxo-propanenitrile CAS Name: 3-[3,3-diethyl-8-hydroxy-6-(5-phenylpentoxy)-2,4-dihydro-1H-naphthalen-1-yl]-3-oxopropanenitrile IUPAC Name: 3-[3,3-diethyl-8-hydroxy-6-(5-phenylpentoxy)-2,4-dihydro-1H-naphthalen-1-yl]-3-oxopropanenitrile Traditional Name: 3-[3,3-diethyl-8-hydroxy-6-(5-phenylpentoxy)tetralin-1-yl]-3-keto-propionitrile Formula: C28H35NO3 MolecularWeight: 433.5824

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Descriptors Computed from Structure

Canonical SMILES:

CCC1(CC(C2=C(C=C(C=C2C1)OCCCCCC3=CC=CC=C3)O)C(=O)CC#N)CC

Isomeric SMILES

CCC1(CC(C2=C(C=C(C=C2C1)OCCCCCC3=CC=CC=C3)O)C(=O)CC#N)CC

InChI

InChI=1S/C28H35NO3/c1-3-28(4-2)19-22-17-23(18-26(31)27(22)24(20-28)25(30)14-15-29)32-16-10-6-9-13-21-11-7-5-8-12-21/h5,7-8,11-12,17-18,24,31H,3-4,6,9-10,13-14,16,19-20H2,1-2H3