2-cycloheptyl-4-[4-methoxy-3-(6-phenoxyhexoxy)phenyl]-4a,5,8,8a-tetrahydrophthalazin-1-one

Systemtic Name: 2-cycloheptyl-4-[4-methoxy-3-(6-phenoxyhexoxy)phenyl]-4a,5,8,8a-tetrahydrophthalazin-1-one Openeye Name: 2-cycloheptyl-4-[4-methoxy-3-(6-phenoxyhexoxy)phenyl]-4a,5,8,8a-tetrahydrophthalazin-1-one CAS Name: 2-cycloheptyl-4-[4-methoxy-3-(6-phenoxyhexoxy)phenyl]-4a,5,8,8a-tetrahydrophthalazin-1-one IUPAC Name: 2-cycloheptyl-4-[4-methoxy-3-(6-phenoxyhexoxy)phenyl]-4a,5,8,8a-tetrahydrophthalazin-1-one Traditional Name: 2-cycloheptyl-4-[4-methoxy-3-(6-phenoxyhexoxy)phenyl]-4a,5,8,8a-tetrahydrophthalazin-1-one Formula: C34H44N2O4 MolecularWeight: 544.72416

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2=NN(C(=O)C3C2CC=CC3)C4CCCCCC4)OCCCCCCOC5=CC=CC=C5

Isomeric SMILES

COC1=C(C=C(C=C1)C2=NN(C(=O)C3C2CC=CC3)C4CCCCCC4)OCCCCCCOC5=CC=CC=C5

InChI

InChI=1S/C34H44N2O4/c1-38-31-22-21-26(25-32(31)40-24-14-5-4-13-23-39-28-17-9-6-10-18-28)33-29-19-11-12-20-30(29)34(37)36(35-33)27-15-7-2-3-8-16-27/h6,9-12,17-18,21-22,25,27,29-30H,2-5,7-8,13-16,19-20,23-24H2,1H3