6-[[3-(aziridin-1-yl)propylamino]methylidene]cyclohexa-2,4-dien-1-one

Systemtic Name: 6-[[3-(aziridin-1-yl)propylamino]methylidene]cyclohexa-2,4-dien-1-one Openeye Name: 6-[[3-(aziridin-1-yl)propylamino]methylene]cyclohexa-2,4-dien-1-one CAS Name: 6-[[3-(1-aziridinyl)propylamino]methylidene]-1-cyclohexa-2,4-dienone IUPAC Name: 6-[[3-(aziridin-1-yl)propylamino]methylidene]cyclohexa-2,4-dien-1-one Traditional Name: 6-[(3-ethyleniminopropylamino)methylene]cyclohexa-2,4-dien-1-one Formula: C12H16N2O MolecularWeight: 204.26824

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Descriptors Computed from Structure

Canonical SMILES:

C1CN1CCCNC=C2C=CC=CC2=O

Isomeric SMILES

C1CN1CCCNC=C2C=CC=CC2=O

InChI

InChI=1S/C12H16N2O/c15-12-5-2-1-4-11(12)10-13-6-3-7-14-8-9-14/h1-2,4-5,10,13H,3,6-9H2