6-nitro-3-[2-oxidanylidene-2-[4-[(4-propan-2-ylphenyl)methyl]piperazin-1-yl]ethyl]-1,3-benzoxazol-2-one

Systemtic Name: 6-nitro-3-[2-oxidanylidene-2-[4-[(4-propan-2-ylphenyl)methyl]piperazin-1-yl]ethyl]-1,3-benzoxazol-2-one Openeye Name: 3-[2-[4-[(4-isopropylphenyl)methyl]piperazin-1-yl]-2-oxo-ethyl]-6-nitro-1,3-benzoxazol-2-one CAS Name: 6-nitro-3-[2-oxo-2-[4-[(4-propan-2-ylphenyl)methyl]-1-piperazinyl]ethyl]-1,3-benzoxazol-2-one IUPAC Name: 6-nitro-3-[2-oxo-2-[4-[(4-propan-2-ylphenyl)methyl]piperazin-1-yl]ethyl]-1,3-benzoxazol-2-one Traditional Name: 3-[2-[4-(4-isopropylbenzyl)piperazino]-2-keto-ethyl]-6-nitro-1,3-benzoxazol-2-one Formula: C23H26N4O5 MolecularWeight: 438.47634

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)CN2CCN(CC2)C(=O)CN3C4=C(C=C(C=C4)[N+](=O)[O-])OC3=O

Isomeric SMILES

CC(C)C1=CC=C(C=C1)CN2CCN(CC2)C(=O)CN3C4=C(C=C(C=C4)[N+](=O)[O-])OC3=O

InChI

InChI=1S/C23H26N4O5/c1-16(2)18-5-3-17(4-6-18)14-24-9-11-25(12-10-24)22(28)15-26-20-8-7-19(27(30)31)13-21(20)32-23(26)29/h3-8,13,16H,9-12,14-15H2,1-2H3