(2S)-2-(4-methyl-3-nitro-phenyl)-3-[[(2R)-oxolan-2-yl]methyl]-1,2-dihydroquinazolin-4-one

Systemtic Name: (2S)-2-(4-methyl-3-nitro-phenyl)-3-[[(2R)-oxolan-2-yl]methyl]-1,2-dihydroquinazolin-4-one Openeye Name: (2S)-2-(4-methyl-3-nitro-phenyl)-3-[[(2R)-tetrahydrofuran-2-yl]methyl]-1,2-dihydroquinazolin-4-one CAS Name: (2S)-2-(4-methyl-3-nitrophenyl)-3-[[(2R)-2-oxolanyl]methyl]-1,2-dihydroquinazolin-4-one IUPAC Name: (2S)-2-(4-methyl-3-nitrophenyl)-3-[[(2R)-oxolan-2-yl]methyl]-1,2-dihydroquinazolin-4-one Traditional Name: (2S)-2-(4-methyl-3-nitro-phenyl)-3-[[(2R)-tetrahydrofuran-2-yl]methyl]-1,2-dihydroquinazolin-4-one Formula: C20H21N3O4 MolecularWeight: 367.39844

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C2NC3=CC=CC=C3C(=O)N2CC4CCCO4)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C(C=C1)[C@H]2NC3=CC=CC=C3C(=O)N2C[C@H]4CCCO4)[N+](=O)[O-]

InChI

InChI=1S/C20H21N3O4/c1-13-8-9-14(11-18(13)23(25)26)19-21-17-7-3-2-6-16(17)20(24)22(19)12-15-5-4-10-27-15/h2-3,6-9,11,15,19,21H,4-5,10,12H2,1H3/t15-,19+/m1/s1