ethane-1,2-diol; 3-ethyl-8-oxidanyl-6-(3-oxidanylpropyl)-4-(phenylmethyl)-3,4-dihydro-2H-naphthalen-1-one

Systemtic Name: ethane-1,2-diol; 3-ethyl-8-oxidanyl-6-(3-oxidanylpropyl)-4-(phenylmethyl)-3,4-dihydro-2H-naphthalen-1-one Openeye Name: 4-benzyl-3-ethyl-8-hydroxy-6-(3-hydroxypropyl)tetralin-1-one; ethylene glycol CAS Name: ethane-1,2-diol; 3-ethyl-8-hydroxy-6-(3-hydroxypropyl)-4-(phenylmethyl)-3,4-dihydro-2H-naphthalen-1-one IUPAC Name: 4-benzyl-3-ethyl-8-hydroxy-6-(3-hydroxypropyl)-3,4-dihydro-2H-naphthalen-1-one; ethane-1,2-diol Traditional Name: 4-benzyl-3-ethyl-8-hydroxy-6-(3-hydroxypropyl)tetralin-1-one; ethylene glycol Formula: C24H32O5 MolecularWeight: 400.50788

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Descriptors Computed from Structure

Canonical SMILES:

CCC1CC(=O)C2=C(C=C(C=C2C1CC3=CC=CC=C3)CCCO)O.C(CO)O

Isomeric SMILES

CCC1CC(=O)C2=C(C=C(C=C2C1CC3=CC=CC=C3)CCCO)O.C(CO)O

InChI

InChI=1S/C22H26O3.C2H6O2/c1-2-17-14-21(25)22-19(12-16(9-6-10-23)13-20(22)24)18(17)11-15-7-4-3-5-8-15;3-1-2-4/h3-5,7-8,12-13,17-18,23-24H,2,6,9-11,14H2,1H3;3-4H,1-2H2