9-decyl-7,10,10-tris(oxidanylidene)-8H-pyreno[2,1-e][1,3]thiazine-9-carbaldehyde

Systemtic Name: 9-decyl-7,10,10-tris(oxidanylidene)-8H-pyreno[2,1-e][1,3]thiazine-9-carbaldehyde Openeye Name: 9-decyl-7,10,10-trioxo-8H-pyreno[2,1-e][1,3]thiazine-9-carbaldehyde CAS Name: 9-decyl-7,10,10-trioxo-8H-pyreno[2,1-e][1,3]thiazine-9-carboxaldehyde IUPAC Name: 9-decyl-7,10,10-trioxo-8H-pyreno[2,1-e][1,3]thiazine-9-carbaldehyde Traditional Name: 9-decyl-7,10,10-triketo-8H-pyreno[2,1-e][1,3]thiazine-9-carbaldehyde Formula: C29H31NO4S MolecularWeight: 489.62574

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCC1(NC(=O)C2=C(S1(=O)=O)C3=C4C(=C2)C=CC5=C4C(=CC=C5)C=C3)C=O

Isomeric SMILES

CCCCCCCCCCC1(NC(=O)C2=C(S1(=O)=O)C3=C4C(=C2)C=CC5=C4C(=CC=C5)C=C3)C=O

InChI

InChI=1S/C29H31NO4S/c1-2-3-4-5-6-7-8-9-17-29(19-31)30-28(32)24-18-22-14-13-20-11-10-12-21-15-16-23(26(22)25(20)21)27(24)35(29,33)34/h10-16,18-19H,2-9,17H2,1H3,(H,30,32)