3-(3-chloranyl-4-methoxy-phenyl)-N-[2-(3,5-dimethylpiperidin-1-yl)-2-oxidanylidene-ethyl]-4-oxidanylidene-phthalazine-1-carboxamide

Systemtic Name: 3-(3-chloranyl-4-methoxy-phenyl)-N-[2-(3,5-dimethylpiperidin-1-yl)-2-oxidanylidene-ethyl]-4-oxidanylidene-phthalazine-1-carboxamide Openeye Name: 3-(3-chloro-4-methoxy-phenyl)-N-[2-(3,5-dimethyl-1-piperidyl)-2-oxo-ethyl]-4-oxo-phthalazine-1-carboxamide CAS Name: 3-(3-chloro-4-methoxyphenyl)-N-[2-(3,5-dimethyl-1-piperidinyl)-2-oxoethyl]-4-oxo-1-phthalazinecarboxamide IUPAC Name: 3-(3-chloro-4-methoxyphenyl)-N-[2-(3,5-dimethylpiperidin-1-yl)-2-oxoethyl]-4-oxophthalazine-1-carboxamide Traditional Name: 3-(3-chloro-4-methoxy-phenyl)-N-[2-(3,5-dimethylpiperidino)-2-keto-ethyl]-4-keto-phthalazine-1-carboxamide Formula: C25H27ClN4O4 MolecularWeight: 482.95928

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(CN(C1)C(=O)CNC(=O)C2=NN(C(=O)C3=CC=CC=C32)C4=CC(=C(C=C4)OC)Cl)C

Isomeric SMILES

CC1CC(CN(C1)C(=O)CNC(=O)C2=NN(C(=O)C3=CC=CC=C32)C4=CC(=C(C=C4)OC)Cl)C

InChI

InChI=1S/C25H27ClN4O4/c1-15-10-16(2)14-29(13-15)22(31)12-27-24(32)23-18-6-4-5-7-19(18)25(33)30(28-23)17-8-9-21(34-3)20(26)11-17/h4-9,11,15-16H,10,12-14H2,1-3H3,(H,27,32)