2-[1-azanyl-3-(4-oxidanylidene-6,7-dihydro-5H-1,2-benzoxazol-3-yl)propylidene]cyclohexane-1,3-dione

Systemtic Name: 2-[1-azanyl-3-(4-oxidanylidene-6,7-dihydro-5H-1,2-benzoxazol-3-yl)propylidene]cyclohexane-1,3-dione Openeye Name: 2-[1-amino-3-(4-oxo-6,7-dihydro-5H-1,2-benzoxazol-3-yl)propylidene]cyclohexane-1,3-dione CAS Name: 2-[1-amino-3-(4-oxo-6,7-dihydro-5H-1,2-benzoxazol-3-yl)propylidene]cyclohexane-1,3-dione IUPAC Name: 2-[1-amino-3-(4-oxo-6,7-dihydro-5H-1,2-benzoxazol-3-yl)propylidene]cyclohexane-1,3-dione Traditional Name: 2-[1-amino-3-(4-keto-6,7-dihydro-5H-indoxazen-3-yl)propylidene]cyclohexane-1,3-quinone Formula: C16H18N2O4 MolecularWeight: 302.32512

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2=C(C(=O)C1)C(=NO2)CCC(=C3C(=O)CCCC3=O)N

Isomeric SMILES

C1CC2=C(C(=O)C1)C(=NO2)CCC(=C3C(=O)CCCC3=O)N

InChI

InChI=1S/C16H18N2O4/c17-9(15-11(19)3-1-4-12(15)20)7-8-10-16-13(21)5-2-6-14(16)22-18-10/h1-8,17H2