N-methyl-9,10,10-tris(oxidanylidene)-N-[(2-propoxynaphthalen-1-yl)methyl]thioxanthene-3-carboxamide

Systemtic Name: N-methyl-9,10,10-tris(oxidanylidene)-N-[(2-propoxynaphthalen-1-yl)methyl]thioxanthene-3-carboxamide Openeye Name: N-methyl-9,10,10-trioxo-N-[(2-propoxy-1-naphthyl)methyl]thioxanthene-3-carboxamide CAS Name: N-methyl-9,10,10-trioxo-N-[(2-propoxy-1-naphthalenyl)methyl]-3-thioxanthenecarboxamide IUPAC Name: N-methyl-9,10,10-trioxo-N-[(2-propoxynaphthalen-1-yl)methyl]thioxanthene-3-carboxamide Traditional Name: 9,10,10-triketo-N-methyl-N-[(2-propoxy-1-naphthyl)methyl]thioxanthene-3-carboxamide Formula: C29H25NO5S MolecularWeight: 499.5775

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=C(C2=CC=CC=C2C=C1)CN(C)C(=O)C3=CC4=C(C=C3)C(=O)C5=CC=CC=C5S4(=O)=O

Isomeric SMILES

CCCOC1=C(C2=CC=CC=C2C=C1)CN(C)C(=O)C3=CC4=C(C=C3)C(=O)C5=CC=CC=C5S4(=O)=O

InChI

InChI=1S/C29H25NO5S/c1-3-16-35-25-15-13-19-8-4-5-9-21(19)24(25)18-30(2)29(32)20-12-14-23-27(17-20)36(33,34)26-11-7-6-10-22(26)28(23)31/h4-15,17H,3,16,18H2,1-2H3