4-(azepan-2-ylidene)-2-(3-methylphenyl)-1,3-oxazol-5-one

Systemtic Name: 4-(azepan-2-ylidene)-2-(3-methylphenyl)-1,3-oxazol-5-one Openeye Name: 4-(azepan-2-ylidene)-2-(m-tolyl)oxazol-5-one CAS Name: 4-(2-azepanylidene)-2-(3-methylphenyl)-5-oxazolone IUPAC Name: 4-(azepan-2-ylidene)-2-(3-methylphenyl)-1,3-oxazol-5-one Traditional Name: 4-(azepan-2-ylidene)-2-(m-tolyl)-2-oxazolin-5-one Formula: C16H18N2O2 MolecularWeight: 270.32632

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C2=NC(=C3CCCCCN3)C(=O)O2

Isomeric SMILES

CC1=CC=CC(=C1)C2=NC(=C3CCCCCN3)C(=O)O2

InChI

InChI=1S/C16H18N2O2/c1-11-6-5-7-12(10-11)15-18-14(16(19)20-15)13-8-3-2-4-9-17-13/h5-7,10,17H,2-4,8-9H2,1H3