N-[(E)-(2,2-dimethyl-4-oxidanidyl-1-oxidanyl-3-thiophen-2-yl-1-aza-4-azoniaspiro[4.5]dec-3-en-10-ylidene)amino]aniline

Systemtic Name: N-[(E)-(2,2-dimethyl-4-oxidanidyl-1-oxidanyl-3-thiophen-2-yl-1-aza-4-azoniaspiro[4.5]dec-3-en-10-ylidene)amino]aniline Openeye Name: N-[(E)-[1-hydroxy-2,2-dimethyl-4-oxido-3-(2-thienyl)-1-aza-4-azoniaspiro[4.5]dec-3-en-10-ylidene]amino]aniline CAS Name: N-[(E)-(1-hydroxy-2,2-dimethyl-4-oxido-3-thiophen-2-yl-1-aza-4-azoniaspiro[4.5]dec-3-en-10-ylidene)amino]aniline IUPAC Name: N-[(E)-(1-hydroxy-2,2-dimethyl-4-oxido-3-thiophen-2-yl-1-aza-4-azoniaspiro[4.5]dec-3-en-10-ylidene)amino]aniline Traditional Name: [(E)-[1-hydroxy-2,2-dimethyl-4-oxido-3-(2-thienyl)-1-aza-4-azoniaspiro[4.5]dec-3-en-10-ylidene]amino]-phenyl-amine Formula: C20H24N4O2S MolecularWeight: 384.49516

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C(=[N+](C2(N1O)CCCCC2=NNC3=CC=CC=C3)[O-])C4=CC=CS4)C

Isomeric SMILES

CC1(C(=[N+](C\2(N1O)CCCC/C2=N\NC3=CC=CC=C3)[O-])C4=CC=CS4)C

InChI

InChI=1S/C20H24N4O2S/c1-19(2)18(16-11-8-14-27-16)23(25)20(24(19)26)13-7-6-12-17(20)22-21-15-9-4-3-5-10-15/h3-5,8-11,14,21,26H,6-7,12-13H2,1-2H3/b22-17+