3-(4-ethoxyphenyl)-N-[3-(2-ethylpiperidin-1-yl)propyl]-4-oxidanylidene-phthalazine-1-carboxamide

Systemtic Name: 3-(4-ethoxyphenyl)-N-[3-(2-ethylpiperidin-1-yl)propyl]-4-oxidanylidene-phthalazine-1-carboxamide Openeye Name: 3-(4-ethoxyphenyl)-N-[3-(2-ethyl-1-piperidyl)propyl]-4-oxo-phthalazine-1-carboxamide CAS Name: 3-(4-ethoxyphenyl)-N-[3-(2-ethyl-1-piperidinyl)propyl]-4-oxo-1-phthalazinecarboxamide IUPAC Name: 3-(4-ethoxyphenyl)-N-[3-(2-ethylpiperidin-1-yl)propyl]-4-oxophthalazine-1-carboxamide Traditional Name: N-[3-(2-ethylpiperidino)propyl]-4-keto-3-p-phenetyl-phthalazine-1-carboxamide Formula: C27H34N4O3 MolecularWeight: 462.58386

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Descriptors Computed from Structure

Canonical SMILES:

CCC1CCCCN1CCCNC(=O)C2=NN(C(=O)C3=CC=CC=C32)C4=CC=C(C=C4)OCC

Isomeric SMILES

CCC1CCCCN1CCCNC(=O)C2=NN(C(=O)C3=CC=CC=C32)C4=CC=C(C=C4)OCC

InChI

InChI=1S/C27H34N4O3/c1-3-20-10-7-8-18-30(20)19-9-17-28-26(32)25-23-11-5-6-12-24(23)27(33)31(29-25)21-13-15-22(16-14-21)34-4-2/h5-6,11-16,20H,3-4,7-10,17-19H2,1-2H3,(H,28,32)