5-(3-methoxyphenyl)-1-methyl-6-(2-oxidanylidenepropyl)-3,4-dihydro-2H-azepin-7-one

Systemtic Name: 5-(3-methoxyphenyl)-1-methyl-6-(2-oxidanylidenepropyl)-3,4-dihydro-2H-azepin-7-one Openeye Name: 6-acetonyl-5-(3-methoxyphenyl)-1-methyl-3,4-dihydro-2H-azepin-7-one CAS Name: 5-(3-methoxyphenyl)-1-methyl-6-(2-oxopropyl)-3,4-dihydro-2H-azepin-7-one IUPAC Name: 5-(3-methoxyphenyl)-1-methyl-6-(2-oxopropyl)-3,4-dihydro-2H-azepin-7-one Traditional Name: 6-acetonyl-5-(3-methoxyphenyl)-1-methyl-3,4-dihydro-2H-azepin-7-one Formula: C17H21NO3 MolecularWeight: 287.35354

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)CC1=C(CCCN(C1=O)C)C2=CC(=CC=C2)OC

Isomeric SMILES

CC(=O)CC1=C(CCCN(C1=O)C)C2=CC(=CC=C2)OC

InChI

InChI=1S/C17H21NO3/c1-12(19)10-16-15(8-5-9-18(2)17(16)20)13-6-4-7-14(11-13)21-3/h4,6-7,11H,5,8-10H2,1-3H3