2-[1-methoxy-2,6-bis(oxidanylidene)cyclohexyl]-3-(methylamino)naphthalene-1,4-dione

Systemtic Name: 2-[1-methoxy-2,6-bis(oxidanylidene)cyclohexyl]-3-(methylamino)naphthalene-1,4-dione Openeye Name: 2-(1-methoxy-2,6-dioxo-cyclohexyl)-3-(methylamino)naphthalene-1,4-dione CAS Name: 2-(1-methoxy-2,6-dioxocyclohexyl)-3-(methylamino)naphthalene-1,4-dione IUPAC Name: 2-(1-methoxy-2,6-dioxocyclohexyl)-3-(methylamino)naphthalene-1,4-dione Traditional Name: 2-(2,6-diketo-1-methoxy-cyclohexyl)-3-(methylamino)-1,4-naphthoquinone Formula: C18H17NO5 MolecularWeight: 327.33128

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Descriptors Computed from Structure

Canonical SMILES:

CNC1=C(C(=O)C2=CC=CC=C2C1=O)C3(C(=O)CCCC3=O)OC

Isomeric SMILES

CNC1=C(C(=O)C2=CC=CC=C2C1=O)C3(C(=O)CCCC3=O)OC

InChI

InChI=1S/C18H17NO5/c1-19-15-14(18(24-2)12(20)8-5-9-13(18)21)16(22)10-6-3-4-7-11(10)17(15)23/h3-4,6-7,19H,5,8-9H2,1-2H3