6-chloranyl-2-[3-[4-(2-ethoxy-2-methyl-3-oxidanylidene-3-piperidin-1-yl-propyl)phenyl]-2-methyl-3-oxidanylidene-propyl]phthalazin-1-one

Systemtic Name: 6-chloranyl-2-[3-[4-(2-ethoxy-2-methyl-3-oxidanylidene-3-piperidin-1-yl-propyl)phenyl]-2-methyl-3-oxidanylidene-propyl]phthalazin-1-one Openeye Name: 6-chloro-2-[3-[4-[2-ethoxy-2-methyl-3-oxo-3-(1-piperidyl)propyl]phenyl]-2-methyl-3-oxo-propyl]phthalazin-1-one CAS Name: 6-chloro-2-[3-[4-[2-ethoxy-2-methyl-3-oxo-3-(1-piperidinyl)propyl]phenyl]-2-methyl-3-oxopropyl]-1-phthalazinone IUPAC Name: 6-chloro-2-[3-[4-(2-ethoxy-2-methyl-3-oxo-3-piperidin-1-ylpropyl)phenyl]-2-methyl-3-oxopropyl]phthalazin-1-one Traditional Name: 6-chloro-2-[3-[4-(2-ethoxy-3-keto-2-methyl-3-piperidino-propyl)phenyl]-3-keto-2-methyl-propyl]phthalazin-1-one Formula: C29H34ClN3O4 MolecularWeight: 524.05096

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(C)(CC1=CC=C(C=C1)C(=O)C(C)CN2C(=O)C3=C(C=C(C=C3)Cl)C=N2)C(=O)N4CCCCC4

Isomeric SMILES

CCOC(C)(CC1=CC=C(C=C1)C(=O)C(C)CN2C(=O)C3=C(C=C(C=C3)Cl)C=N2)C(=O)N4CCCCC4

InChI

InChI=1S/C29H34ClN3O4/c1-4-37-29(3,28(36)32-14-6-5-7-15-32)17-21-8-10-22(11-9-21)26(34)20(2)19-33-27(35)25-13-12-24(30)16-23(25)18-31-33/h8-13,16,18,20H,4-7,14-15,17,19H2,1-3H3