3-[1,4-bis(oxidanylidene)-3H-phthalazin-2-yl]-N-[(4S)-3,4-dihydro-2H-chromen-4-yl]propanamide

Systemtic Name: 3-[1,4-bis(oxidanylidene)-3H-phthalazin-2-yl]-N-[(4S)-3,4-dihydro-2H-chromen-4-yl]propanamide Openeye Name: N-[(4S)-chroman-4-yl]-3-(1,4-dioxo-3H-phthalazin-2-yl)propanamide CAS Name: N-[(4S)-3,4-dihydro-2H-1-benzopyran-4-yl]-3-(1,4-dioxo-3H-phthalazin-2-yl)propanamide IUPAC Name: N-[(4S)-3,4-dihydro-2H-chromen-4-yl]-3-(1,4-dioxo-3H-phthalazin-2-yl)propanamide Traditional Name: N-[(4S)-chroman-4-yl]-3-(1,4-diketo-3H-phthalazin-2-yl)propionamide Formula: C20H19N3O4 MolecularWeight: 365.38256

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=CC=CC=C2C1NC(=O)CCN3C(=O)C4=CC=CC=C4C(=O)N3

Isomeric SMILES

C1COC2=CC=CC=C2[C@H]1NC(=O)CCN3C(=O)C4=CC=CC=C4C(=O)N3

InChI

InChI=1S/C20H19N3O4/c24-18(21-16-10-12-27-17-8-4-3-7-15(16)17)9-11-23-20(26)14-6-2-1-5-13(14)19(25)22-23/h1-8,16H,9-12H2,(H,21,24)(H,22,25)/t16-/m0/s1