N-[3-(dipropylamino)propyl]-3-(4-ethoxyphenyl)-4-oxidanylidene-phthalazine-1-carboxamide

Systemtic Name: N-[3-(dipropylamino)propyl]-3-(4-ethoxyphenyl)-4-oxidanylidene-phthalazine-1-carboxamide Openeye Name: N-[3-(dipropylamino)propyl]-3-(4-ethoxyphenyl)-4-oxo-phthalazine-1-carboxamide CAS Name: N-[3-(dipropylamino)propyl]-3-(4-ethoxyphenyl)-4-oxo-1-phthalazinecarboxamide IUPAC Name: N-[3-(dipropylamino)propyl]-3-(4-ethoxyphenyl)-4-oxophthalazine-1-carboxamide Traditional Name: N-[3-(dipropylamino)propyl]-4-keto-3-p-phenetyl-phthalazine-1-carboxamide Formula: C26H34N4O3 MolecularWeight: 450.57316

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCN(CCC)CCCNC(=O)C1=NN(C(=O)C2=CC=CC=C21)C3=CC=C(C=C3)OCC

Isomeric SMILES

CCCN(CCC)CCCNC(=O)C1=NN(C(=O)C2=CC=CC=C21)C3=CC=C(C=C3)OCC

InChI

InChI=1S/C26H34N4O3/c1-4-17-29(18-5-2)19-9-16-27-25(31)24-22-10-7-8-11-23(22)26(32)30(28-24)20-12-14-21(15-13-20)33-6-3/h7-8,10-15H,4-6,9,16-19H2,1-3H3,(H,27,31)