1-[(5-azanyl-2-methoxy-phenyl)methyl]azepane-2,7-dione

Systemtic Name: 1-[(5-azanyl-2-methoxy-phenyl)methyl]azepane-2,7-dione Openeye Name: 1-[(5-amino-2-methoxy-phenyl)methyl]azepane-2,7-dione CAS Name: 1-[(5-amino-2-methoxyphenyl)methyl]azepane-2,7-dione IUPAC Name: 1-[(5-amino-2-methoxyphenyl)methyl]azepane-2,7-dione Traditional Name: 1-(5-amino-2-methoxy-benzyl)azepane-2,7-quinone Formula: C14H18N2O3 MolecularWeight: 262.30432

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)N)CN2C(=O)CCCCC2=O

Isomeric SMILES

COC1=C(C=C(C=C1)N)CN2C(=O)CCCCC2=O

InChI

InChI=1S/C14H18N2O3/c1-19-12-7-6-11(15)8-10(12)9-16-13(17)4-2-3-5-14(16)18/h6-8H,2-5,9,15H2,1H3