3-(3-chloranyl-4-methoxy-phenyl)-N-[2-[3-(diethylamino)propylamino]-2-oxidanylidene-ethyl]-4-oxidanylidene-phthalazine-1-carboxamide

Systemtic Name: 3-(3-chloranyl-4-methoxy-phenyl)-N-[2-[3-(diethylamino)propylamino]-2-oxidanylidene-ethyl]-4-oxidanylidene-phthalazine-1-carboxamide Openeye Name: 3-(3-chloro-4-methoxy-phenyl)-N-[2-[3-(diethylamino)propylamino]-2-oxo-ethyl]-4-oxo-phthalazine-1-carboxamide CAS Name: 3-(3-chloro-4-methoxyphenyl)-N-[2-[3-(diethylamino)propylamino]-2-oxoethyl]-4-oxo-1-phthalazinecarboxamide IUPAC Name: 3-(3-chloro-4-methoxyphenyl)-N-[2-[3-(diethylamino)propylamino]-2-oxoethyl]-4-oxophthalazine-1-carboxamide Traditional Name: 3-(3-chloro-4-methoxy-phenyl)-N-[2-[3-(diethylamino)propylamino]-2-keto-ethyl]-4-keto-phthalazine-1-carboxamide Formula: C25H30ClN5O4 MolecularWeight: 499.9898

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CCCNC(=O)CNC(=O)C1=NN(C(=O)C2=CC=CC=C21)C3=CC(=C(C=C3)OC)Cl

Isomeric SMILES

CCN(CC)CCCNC(=O)CNC(=O)C1=NN(C(=O)C2=CC=CC=C21)C3=CC(=C(C=C3)OC)Cl

InChI

InChI=1S/C25H30ClN5O4/c1-4-30(5-2)14-8-13-27-22(32)16-28-24(33)23-18-9-6-7-10-19(18)25(34)31(29-23)17-11-12-21(35-3)20(26)15-17/h6-7,9-12,15H,4-5,8,13-14,16H2,1-3H3,(H,27,32)(H,28,33)