3-[7-butyl-3,4-bis(chloranyl)-9,10,11-trimethyl-8-propan-2-yl-heptadecan-8-yl]-1H-pyridazin-6-one

Systemtic Name: 3-[7-butyl-3,4-bis(chloranyl)-9,10,11-trimethyl-8-propan-2-yl-heptadecan-8-yl]-1H-pyridazin-6-one Openeye Name: 3-[1-(1-butyl-4,5-dichloro-heptyl)-1-isopropyl-2,3,4-trimethyl-decyl]-1H-pyridazin-6-one CAS Name: 3-(7-butyl-3,4-dichloro-9,10,11-trimethyl-8-propan-2-ylheptadecan-8-yl)-1H-pyridazin-6-one IUPAC Name: 3-(7-butyl-3,4-dichloro-9,10,11-trimethyl-8-propan-2-ylheptadecan-8-yl)-1H-pyridazin-6-one Traditional Name: 3-[1-(1-butyl-4,5-dichloro-heptyl)-1-isopropyl-2,3,4-trimethyl-decyl]-1H-pyridazin-6-one Formula: C31H56Cl2N2O MolecularWeight: 543.69514

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(C)C(C)C(C)C(C1=NNC(=O)C=C1)(C(C)C)C(CCCC)CCC(C(CC)Cl)Cl

Isomeric SMILES

CCCCCCC(C)C(C)C(C)C(C1=NNC(=O)C=C1)(C(C)C)C(CCCC)CCC(C(CC)Cl)Cl

InChI

InChI=1S/C31H56Cl2N2O/c1-9-12-14-15-16-23(6)24(7)25(8)31(22(4)5,29-20-21-30(36)35-34-29)26(17-13-10-2)18-19-28(33)27(32)11-3/h20-28H,9-19H2,1-8H3,(H,35,36)