6-nitro-3-[4-oxidanylidene-4-(4-propan-2-ylpiperazin-1-yl)butyl]-1,3-benzoxazol-2-one

Systemtic Name: 6-nitro-3-[4-oxidanylidene-4-(4-propan-2-ylpiperazin-1-yl)butyl]-1,3-benzoxazol-2-one Openeye Name: 3-[4-(4-isopropylpiperazin-1-yl)-4-oxo-butyl]-6-nitro-1,3-benzoxazol-2-one CAS Name: 6-nitro-3-[4-oxo-4-(4-propan-2-yl-1-piperazinyl)butyl]-1,3-benzoxazol-2-one IUPAC Name: 6-nitro-3-[4-oxo-4-(4-propan-2-ylpiperazin-1-yl)butyl]-1,3-benzoxazol-2-one Traditional Name: 3-[4-(4-isopropylpiperazino)-4-keto-butyl]-6-nitro-1,3-benzoxazol-2-one Formula: C18H24N4O5 MolecularWeight: 376.40696

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N1CCN(CC1)C(=O)CCCN2C3=C(C=C(C=C3)[N+](=O)[O-])OC2=O

Isomeric SMILES

CC(C)N1CCN(CC1)C(=O)CCCN2C3=C(C=C(C=C3)[N+](=O)[O-])OC2=O

InChI

InChI=1S/C18H24N4O5/c1-13(2)19-8-10-20(11-9-19)17(23)4-3-7-21-15-6-5-14(22(25)26)12-16(15)27-18(21)24/h5-6,12-13H,3-4,7-11H2,1-2H3