N-[[(3R)-3,4-dihydro-2H-chromen-3-yl]methyl]-4-oxidanylidene-3-propyl-phthalazine-1-carboxamide

Systemtic Name: N-[[(3R)-3,4-dihydro-2H-chromen-3-yl]methyl]-4-oxidanylidene-3-propyl-phthalazine-1-carboxamide Openeye Name: N-[[(3R)-chroman-3-yl]methyl]-4-oxo-3-propyl-phthalazine-1-carboxamide CAS Name: N-[[(3R)-3,4-dihydro-2H-1-benzopyran-3-yl]methyl]-4-oxo-3-propyl-1-phthalazinecarboxamide IUPAC Name: N-[[(3R)-3,4-dihydro-2H-chromen-3-yl]methyl]-4-oxo-3-propylphthalazine-1-carboxamide Traditional Name: N-[[(3R)-chroman-3-yl]methyl]-4-keto-3-propyl-phthalazine-1-carboxamide Formula: C22H23N3O3 MolecularWeight: 377.43632

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NCC3CC4=CC=CC=C4OC3

Isomeric SMILES

CCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NC[C@H]3CC4=CC=CC=C4OC3

InChI

InChI=1S/C22H23N3O3/c1-2-11-25-22(27)18-9-5-4-8-17(18)20(24-25)21(26)23-13-15-12-16-7-3-6-10-19(16)28-14-15/h3-10,15H,2,11-14H2,1H3,(H,23,26)/t15-/m1/s1