methyl 4-oxidanylidene-4-[(9-oxidanylidenethioxanthen-2-yl)amino]butanoate

Systemtic Name: methyl 4-oxidanylidene-4-[(9-oxidanylidenethioxanthen-2-yl)amino]butanoate Openeye Name: methyl 4-oxo-4-[(9-oxothioxanthen-2-yl)amino]butanoate CAS Name: 4-oxo-4-[(9-oxo-2-thioxanthenyl)amino]butanoic acid methyl ester IUPAC Name: methyl 4-oxo-4-[(9-oxothioxanthen-2-yl)amino]butanoate Traditional Name: 4-keto-4-[(9-ketothioxanthen-2-yl)amino]butyric acid methyl ester Formula: C18H15NO4S MolecularWeight: 341.381

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCC(=O)NC1=CC2=C(C=C1)SC3=CC=CC=C3C2=O

Isomeric SMILES

COC(=O)CCC(=O)NC1=CC2=C(C=C1)SC3=CC=CC=C3C2=O

InChI

InChI=1S/C18H15NO4S/c1-23-17(21)9-8-16(20)19-11-6-7-15-13(10-11)18(22)12-4-2-3-5-14(12)24-15/h2-7,10H,8-9H2,1H3,(H,19,20)