1-(azepan-1-yl)-2-[(3-ethynylphenyl)amino]propan-1-one

Systemtic Name: 1-(azepan-1-yl)-2-[(3-ethynylphenyl)amino]propan-1-one Openeye Name: 1-(azepan-1-yl)-2-(3-ethynylanilino)propan-1-one CAS Name: 1-(1-azepanyl)-2-(3-ethynylanilino)-1-propanone IUPAC Name: 1-(azepan-1-yl)-2-(3-ethynylanilino)propan-1-one Traditional Name: 1-(azepan-1-yl)-2-(3-ethynylanilino)propan-1-one Formula: C17H22N2O MolecularWeight: 270.36938

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N1CCCCCC1)NC2=CC=CC(=C2)C#C

Isomeric SMILES

CC(C(=O)N1CCCCCC1)NC2=CC=CC(=C2)C#C

InChI

InChI=1S/C17H22N2O/c1-3-15-9-8-10-16(13-15)18-14(2)17(20)19-11-6-4-5-7-12-19/h1,8-10,13-14,18H,4-7,11-12H2,2H3