3-[3-oxidanylidene-3-[6-oxidanylidene-4-phenyl-2-(propylamino)cyclohexen-1-yl]propyl]-6,7-dihydro-5H-1,2-benzoxazol-4-one

Systemtic Name: 3-[3-oxidanylidene-3-[6-oxidanylidene-4-phenyl-2-(propylamino)cyclohexen-1-yl]propyl]-6,7-dihydro-5H-1,2-benzoxazol-4-one Openeye Name: 3-[3-oxo-3-[6-oxo-4-phenyl-2-(propylamino)cyclohexen-1-yl]propyl]-6,7-dihydro-5H-1,2-benzoxazol-4-one CAS Name: 3-[3-oxo-3-[6-oxo-4-phenyl-2-(propylamino)-1-cyclohexenyl]propyl]-6,7-dihydro-5H-1,2-benzoxazol-4-one IUPAC Name: 3-[3-oxo-3-[6-oxo-4-phenyl-2-(propylamino)cyclohexen-1-yl]propyl]-6,7-dihydro-5H-1,2-benzoxazol-4-one Traditional Name: 3-[3-keto-3-[6-keto-4-phenyl-2-(propylamino)cyclohexen-1-yl]propyl]-6,7-dihydro-5H-indoxazen-4-one Formula: C25H28N2O4 MolecularWeight: 420.50082

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC1=C(C(=O)CC(C1)C2=CC=CC=C2)C(=O)CCC3=NOC4=C3C(=O)CCC4

Isomeric SMILES

CCCNC1=C(C(=O)CC(C1)C2=CC=CC=C2)C(=O)CCC3=NOC4=C3C(=O)CCC4

InChI

InChI=1S/C25H28N2O4/c1-2-13-26-19-14-17(16-7-4-3-5-8-16)15-22(30)24(19)21(29)12-11-18-25-20(28)9-6-10-23(25)31-27-18/h3-5,7-8,17,26H,2,6,9-15H2,1H3