N-[(1R)-1-(3,4-diethoxyphenyl)-2-methyl-propyl]-4-oxidanylidene-3-propyl-phthalazine-1-carboxamide

Systemtic Name: N-[(1R)-1-(3,4-diethoxyphenyl)-2-methyl-propyl]-4-oxidanylidene-3-propyl-phthalazine-1-carboxamide Openeye Name: N-[(1R)-1-(3,4-diethoxyphenyl)-2-methyl-propyl]-4-oxo-3-propyl-phthalazine-1-carboxamide CAS Name: N-[(1R)-1-(3,4-diethoxyphenyl)-2-methylpropyl]-4-oxo-3-propyl-1-phthalazinecarboxamide IUPAC Name: N-[(1R)-1-(3,4-diethoxyphenyl)-2-methylpropyl]-4-oxo-3-propylphthalazine-1-carboxamide Traditional Name: N-[(1R)-1-(3,4-diethoxyphenyl)-2-methyl-propyl]-4-keto-3-propyl-phthalazine-1-carboxamide Formula: C26H33N3O4 MolecularWeight: 451.55792

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NC(C3=CC(=C(C=C3)OCC)OCC)C(C)C

Isomeric SMILES

CCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)N[C@@H](C3=CC(=C(C=C3)OCC)OCC)C(C)C

InChI

InChI=1S/C26H33N3O4/c1-6-15-29-26(31)20-12-10-9-11-19(20)24(28-29)25(30)27-23(17(4)5)18-13-14-21(32-7-2)22(16-18)33-8-3/h9-14,16-17,23H,6-8,15H2,1-5H3,(H,27,30)/t23-/m1/s1