1-[2-azanyl-2-(4-methoxyphenyl)ethyl]azepane-2,7-dione

Systemtic Name: 1-[2-azanyl-2-(4-methoxyphenyl)ethyl]azepane-2,7-dione Openeye Name: 1-[2-amino-2-(4-methoxyphenyl)ethyl]azepane-2,7-dione CAS Name: 1-[2-amino-2-(4-methoxyphenyl)ethyl]azepane-2,7-dione IUPAC Name: 1-[2-amino-2-(4-methoxyphenyl)ethyl]azepane-2,7-dione Traditional Name: 1-[2-amino-2-(4-methoxyphenyl)ethyl]azepane-2,7-quinone Formula: C15H20N2O3 MolecularWeight: 276.3309

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H20N2O3/c1-20-12-8-6-11(7-9-12)13(16)10-17-14(18)4-2-3-5-15(17)19/h6-9,13H,2-5,10,16H2,1H3