prop-2-enyl 8-oxidanylidene-3-propylsulfanyl-acenaphthyleno[1,2-b]pyrrole-9-carboxylate

Systemtic Name: prop-2-enyl 8-oxidanylidene-3-propylsulfanyl-acenaphthyleno[1,2-b]pyrrole-9-carboxylate Openeye Name: allyl 8-oxo-3-propylsulfanyl-acenaphthyleno[1,2-b]pyrrole-9-carboxylate CAS Name: 8-oxo-3-(propylthio)-9-acenaphthyleno[1,2-b]pyrrolecarboxylic acid prop-2-enyl ester IUPAC Name: prop-2-enyl 8-oxo-3-propylsulfanylacenaphthyleno[1,2-b]pyrrole-9-carboxylate Traditional Name: 8-keto-3-(propylthio)acenaphtho[1,2-b]pyrrole-9-carboxylic acid allyl ester Formula: C21H17NO3S MolecularWeight: 363.42958

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Descriptors Computed from Structure

Canonical SMILES:

CCCSC1=C2C=CC=C3C2=C(C=C1)C4=C(C(=O)N=C34)C(=O)OCC=C

Isomeric SMILES

CCCSC1=C2C=CC=C3C2=C(C=C1)C4=C(C(=O)N=C34)C(=O)OCC=C

InChI

InChI=1S/C21H17NO3S/c1-3-10-25-21(24)18-17-13-8-9-15(26-11-4-2)12-6-5-7-14(16(12)13)19(17)22-20(18)23/h3,5-9H,1,4,10-11H2,2H3