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

Systemtic Name: 3-(3-chloranyl-4-methoxy-phenyl)-N-[2-[3-(2-ethylpiperidin-1-yl)propylamino]-2-oxidanylidene-ethyl]-4-oxidanylidene-phthalazine-1-carboxamide Openeye Name: 3-(3-chloro-4-methoxy-phenyl)-N-[2-[3-(2-ethyl-1-piperidyl)propylamino]-2-oxo-ethyl]-4-oxo-phthalazine-1-carboxamide CAS Name: 3-(3-chloro-4-methoxyphenyl)-N-[2-[3-(2-ethyl-1-piperidinyl)propylamino]-2-oxoethyl]-4-oxo-1-phthalazinecarboxamide IUPAC Name: 3-(3-chloro-4-methoxyphenyl)-N-[2-[3-(2-ethylpiperidin-1-yl)propylamino]-2-oxoethyl]-4-oxophthalazine-1-carboxamide Traditional Name: 3-(3-chloro-4-methoxy-phenyl)-N-[2-[3-(2-ethylpiperidino)propylamino]-2-keto-ethyl]-4-keto-phthalazine-1-carboxamide Formula: C28H34ClN5O4 MolecularWeight: 540.05366

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1CCCCN1CCCNC(=O)CNC(=O)C2=NN(C(=O)C3=CC=CC=C32)C4=CC(=C(C=C4)OC)Cl

Isomeric SMILES

CCC1CCCCN1CCCNC(=O)CNC(=O)C2=NN(C(=O)C3=CC=CC=C32)C4=CC(=C(C=C4)OC)Cl

InChI

InChI=1S/C28H34ClN5O4/c1-3-19-9-6-7-15-33(19)16-8-14-30-25(35)18-31-27(36)26-21-10-4-5-11-22(21)28(37)34(32-26)20-12-13-24(38-2)23(29)17-20/h4-5,10-13,17,19H,3,6-9,14-16,18H2,1-2H3,(H,30,35)(H,31,36)