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

Systemtic Name: 3-[4-(3,4-dihydro-2H-quinolin-1-yl)-4-oxidanylidene-butyl]-6-nitro-1,3-benzoxazol-2-one Openeye Name: 3-[4-(3,4-dihydro-2H-quinolin-1-yl)-4-oxo-butyl]-6-nitro-1,3-benzoxazol-2-one CAS Name: 3-[4-(3,4-dihydro-2H-quinolin-1-yl)-4-oxobutyl]-6-nitro-1,3-benzoxazol-2-one IUPAC Name: 3-[4-(3,4-dihydro-2H-quinolin-1-yl)-4-oxobutyl]-6-nitro-1,3-benzoxazol-2-one Traditional Name: 3-[4-(3,4-dihydro-2H-quinolin-1-yl)-4-keto-butyl]-6-nitro-1,3-benzoxazol-2-one Formula: C20H19N3O5 MolecularWeight: 381.38196

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2=CC=CC=C2N(C1)C(=O)CCCN3C4=C(C=C(C=C4)[N+](=O)[O-])OC3=O

Isomeric SMILES

C1CC2=CC=CC=C2N(C1)C(=O)CCCN3C4=C(C=C(C=C4)[N+](=O)[O-])OC3=O

InChI

InChI=1S/C20H19N3O5/c24-19(21-11-3-6-14-5-1-2-7-16(14)21)8-4-12-22-17-10-9-15(23(26)27)13-18(17)28-20(22)25/h1-2,5,7,9-10,13H,3-4,6,8,11-12H2