(3Z)-2-oxidanylidene-3-[5-(piperidin-1-ylmethyl)-1H-pyridin-2-ylidene]-1H-indole-6-carbonitrile hydrochloride

Systemtic Name: (3Z)-2-oxidanylidene-3-[5-(piperidin-1-ylmethyl)-1H-pyridin-2-ylidene]-1H-indole-6-carbonitrile hydrochloride Openeye Name: (3Z)-2-oxo-3-[5-(1-piperidylmethyl)-1H-pyridin-2-ylidene]indoline-6-carbonitrile hydrochloride CAS Name: (3Z)-2-oxo-3-[5-(1-piperidinylmethyl)-1H-pyridin-2-ylidene]-1H-indole-6-carbonitrile hydrochloride IUPAC Name: (3Z)-2-oxo-3-[5-(piperidin-1-ylmethyl)-1H-pyridin-2-ylidene]-1H-indole-6-carbonitrile hydrochloride Traditional Name: (3Z)-2-keto-3-[5-(piperidinomethyl)-1H-pyridin-2-ylidene]indoline-6-carbonitrile hydrochloride Formula: C20H21ClN4O MolecularWeight: 368.85994

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)CC2=CNC(=C3C4=C(C=C(C=C4)C#N)NC3=O)C=C2.Cl

Isomeric SMILES

C1CCN(CC1)CC2=CN/C(=C\3/C4=C(C=C(C=C4)C#N)NC3=O)/C=C2.Cl

InChI

InChI=1S/C20H20N4O.ClH/c21-11-14-4-6-16-18(10-14)23-20(25)19(16)17-7-5-15(12-22-17)13-24-8-2-1-3-9-24;/h4-7,10,12,22H,1-3,8-9,13H2,(H,23,25);1H/b19-17-;