indol-3-ylidene-[(4-methylpiperazin-4-ium-1-yl)sulfonylamino]methanolate

Systemtic Name: indol-3-ylidene-[(4-methylpiperazin-4-ium-1-yl)sulfonylamino]methanolate Openeye Name: indol-3-ylidene-[(4-methylpiperazin-4-ium-1-yl)sulfonylamino]methanolate CAS Name: 3-indolylidene-[(4-methyl-1-piperazin-4-iumyl)sulfonylamino]methanolate IUPAC Name: indol-3-ylidene-[(4-methylpiperazin-4-ium-1-yl)sulfonylamino]methanolate Traditional Name: indol-3-ylidene-[(4-methylpiperazin-4-ium-1-yl)sulfonylamino]methanolate Formula: C14H18N4O3S MolecularWeight: 322.38272

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCN(CC1)S(=O)(=O)NC(=C2C=NC3=CC=CC=C32)[O-]

Isomeric SMILES

C[NH+]1CCN(CC1)S(=O)(=O)NC(=C2C=NC3=CC=CC=C32)[O-]

InChI

InChI=1S/C14H18N4O3S/c1-17-6-8-18(9-7-17)22(20,21)16-14(19)12-10-15-13-5-3-2-4-11(12)13/h2-5,10,16,19H,6-9H2,1H3