butanedioic acid; (3E)-3-(2-tert-butylthioxanthen-9-ylidene)-N,N-dimethyl-propan-1-amine

Systemtic Name: butanedioic acid; (3E)-3-(2-tert-butylthioxanthen-9-ylidene)-N,N-dimethyl-propan-1-amine Openeye Name: (3E)-3-(2-tert-butylthioxanthen-9-ylidene)-N,N-dimethyl-propan-1-amine; succinic acid CAS Name: butanedioic acid; (3E)-3-(2-tert-butyl-9-thioxanthenylidene)-N,N-dimethyl-1-propanamine IUPAC Name: butanedioic acid; (3E)-3-(2-tert-butylthioxanthen-9-ylidene)-N,N-dimethylpropan-1-amine Traditional Name: [(3E)-3-(2-tert-butylthioxanthen-9-ylidene)propyl]-dimethyl-amine; succinic acid Formula: C26H33NO4S MolecularWeight: 455.60952

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC2=C(C=C1)SC3=CC=CC=C3C2=CCCN(C)C.C(CC(=O)O)C(=O)O

Isomeric SMILES

CC(C)(C)C1=CC\2=C(C=C1)SC3=CC=CC=C3/C2=C\CCN(C)C.C(CC(=O)O)C(=O)O

InChI

InChI=1S/C22H27NS.C4H6O4/c1-22(2,3)16-12-13-21-19(15-16)17(10-8-14-23(4)5)18-9-6-7-11-20(18)24-21;5-3(6)1-2-4(7)8/h6-7,9-13,15H,8,14H2,1-5H3;1-2H2,(H,5,6)(H,7,8)/b17-10+;