3-[4-[(2S)-2-(2,3-dihydro-1,4-benzodioxin-6-yl)pyrrolidin-1-yl]carbonylphenyl]quinazolin-4-one

Systemtic Name: 3-[4-[(2S)-2-(2,3-dihydro-1,4-benzodioxin-6-yl)pyrrolidin-1-yl]carbonylphenyl]quinazolin-4-one Openeye Name: 3-[4-[(2S)-2-(2,3-dihydro-1,4-benzodioxin-6-yl)pyrrolidine-1-carbonyl]phenyl]quinazolin-4-one CAS Name: 3-[4-[[(2S)-2-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-pyrrolidinyl]-oxomethyl]phenyl]-4-quinazolinone IUPAC Name: 3-[4-[(2S)-2-(2,3-dihydro-1,4-benzodioxin-6-yl)pyrrolidine-1-carbonyl]phenyl]quinazolin-4-one Traditional Name: 3-[4-[(2S)-2-(2,3-dihydro-1,4-benzodioxin-6-yl)pyrrolidine-1-carbonyl]phenyl]quinazolin-4-one Formula: C27H23N3O4 MolecularWeight: 453.48922

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(N(C1)C(=O)C2=CC=C(C=C2)N3C=NC4=CC=CC=C4C3=O)C5=CC6=C(C=C5)OCCO6

Isomeric SMILES

C1C[C@H](N(C1)C(=O)C2=CC=C(C=C2)N3C=NC4=CC=CC=C4C3=O)C5=CC6=C(C=C5)OCCO6

InChI

InChI=1S/C27H23N3O4/c31-26(29-13-3-6-23(29)19-9-12-24-25(16-19)34-15-14-33-24)18-7-10-20(11-8-18)30-17-28-22-5-2-1-4-21(22)27(30)32/h1-2,4-5,7-12,16-17,23H,3,6,13-15H2/t23-/m0/s1