(6E)-6-[(azepan-1-ylamino)methylidene]-4-chloranyl-cyclohexa-2,4-dien-1-one

Systemtic Name: (6E)-6-[(azepan-1-ylamino)methylidene]-4-chloranyl-cyclohexa-2,4-dien-1-one Openeye Name: (6E)-6-[(azepan-1-ylamino)methylene]-4-chloro-cyclohexa-2,4-dien-1-one CAS Name: (6E)-6-[(1-azepanylamino)methylidene]-4-chloro-1-cyclohexa-2,4-dienone IUPAC Name: (6E)-6-[(azepan-1-ylamino)methylidene]-4-chlorocyclohexa-2,4-dien-1-one Traditional Name: (6E)-6-[(azepan-1-ylamino)methylene]-4-chloro-cyclohexa-2,4-dien-1-one Formula: C13H17ClN2O MolecularWeight: 252.73988

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)NC=C2C=C(C=CC2=O)Cl

Isomeric SMILES

C1CCCN(CC1)N/C=C/2\C=C(C=CC2=O)Cl

InChI

InChI=1S/C13H17ClN2O/c14-12-5-6-13(17)11(9-12)10-15-16-7-3-1-2-4-8-16/h5-6,9-10,15H,1-4,7-8H2/b11-10+