3-[4-(6-methoxy-3,4-dihydro-2H-quinolin-1-yl)-4-oxidanylidene-butyl]-6-nitro-1,3-benzoxazol-2-one

Systemtic Name: 3-[4-(6-methoxy-3,4-dihydro-2H-quinolin-1-yl)-4-oxidanylidene-butyl]-6-nitro-1,3-benzoxazol-2-one Openeye Name: 3-[4-(6-methoxy-3,4-dihydro-2H-quinolin-1-yl)-4-oxo-butyl]-6-nitro-1,3-benzoxazol-2-one CAS Name: 3-[4-(6-methoxy-3,4-dihydro-2H-quinolin-1-yl)-4-oxobutyl]-6-nitro-1,3-benzoxazol-2-one IUPAC Name: 3-[4-(6-methoxy-3,4-dihydro-2H-quinolin-1-yl)-4-oxobutyl]-6-nitro-1,3-benzoxazol-2-one Traditional Name: 3-[4-keto-4-(6-methoxy-3,4-dihydro-2H-quinolin-1-yl)butyl]-6-nitro-1,3-benzoxazol-2-one Formula: C21H21N3O6 MolecularWeight: 411.40794

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)N(CCC2)C(=O)CCCN3C4=C(C=C(C=C4)[N+](=O)[O-])OC3=O

Isomeric SMILES

COC1=CC2=C(C=C1)N(CCC2)C(=O)CCCN3C4=C(C=C(C=C4)[N+](=O)[O-])OC3=O

InChI

InChI=1S/C21H21N3O6/c1-29-16-7-9-17-14(12-16)4-2-10-22(17)20(25)5-3-11-23-18-8-6-15(24(27)28)13-19(18)30-21(23)26/h6-9,12-13H,2-5,10-11H2,1H3