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

Systemtic Name: 1-[2-azanyl-2-(2-methoxy-5-methyl-phenyl)ethyl]azepane-2,7-dione Openeye Name: 1-[2-amino-2-(2-methoxy-5-methyl-phenyl)ethyl]azepane-2,7-dione CAS Name: 1-[2-amino-2-(2-methoxy-5-methylphenyl)ethyl]azepane-2,7-dione IUPAC Name: 1-[2-amino-2-(2-methoxy-5-methylphenyl)ethyl]azepane-2,7-dione Traditional Name: 1-[2-amino-2-(2-methoxy-5-methyl-phenyl)ethyl]azepane-2,7-quinone Formula: C16H22N2O3 MolecularWeight: 290.35748

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)OC)C(CN2C(=O)CCCCC2=O)N

Isomeric SMILES

CC1=CC(=C(C=C1)OC)C(CN2C(=O)CCCCC2=O)N

InChI

InChI=1S/C16H22N2O3/c1-11-7-8-14(21-2)12(9-11)13(17)10-18-15(19)5-3-4-6-16(18)20/h7-9,13H,3-6,10,17H2,1-2H3