carbanide; chloranyltitanium(1+); (6Z)-6-[(quinolin-8-ylamino)methylidene]cyclohexa-2,4-dien-1-one

Systemtic Name: carbanide; chloranyltitanium(1+); (6Z)-6-[(quinolin-8-ylamino)methylidene]cyclohexa-2,4-dien-1-one Openeye Name: carbanide; chlorotitanium(1+); (6Z)-6-[(8-quinolylamino)methylene]cyclohexa-2,4-dien-1-one CAS Name: carbanide; chlorotitanium(1+); (6Z)-6-[(8-quinolinylamino)methylidene]-1-cyclohexa-2,4-dienone IUPAC Name: carbanide; chlorotitanium(1+); (6Z)-6-[(quinolin-8-ylamino)methylidene]cyclohexa-2,4-dien-1-one Traditional Name: carbanide; chlorotitanium(1+); (6Z)-6-[(8-quinolylamino)methylene]cyclohexa-2,4-dien-1-one Formula: C17H15ClN2OTi MolecularWeight: 346.6338

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Descriptors Computed from Structure

Canonical SMILES:

[CH3-].C1=CC(=CNC2=CC=CC3=C2N=CC=C3)C(=O)C=C1.Cl[Ti+]

Isomeric SMILES

[CH3-].C1=C/C(=C/NC2=CC=CC3=C2N=CC=C3)/C(=O)C=C1.Cl[Ti+]

InChI

InChI=1S/C16H12N2O.CH3.ClH.Ti/c19-15-9-2-1-5-13(15)11-18-14-8-3-6-12-7-4-10-17-16(12)14;;;/h1-11,18H;1H3;1H;/q;-1;;+2/p-1/b13-11-;;;