3-(1,3-benzoxazol-2-ylsulfanyl)-1-(5-nitro-2,3-dihydroindol-1-yl)propan-1-one

Systemtic Name: 3-(1,3-benzoxazol-2-ylsulfanyl)-1-(5-nitro-2,3-dihydroindol-1-yl)propan-1-one Openeye Name: 3-(1,3-benzoxazol-2-ylsulfanyl)-1-(5-nitroindolin-1-yl)propan-1-one CAS Name: 3-(1,3-benzoxazol-2-ylthio)-1-(5-nitro-2,3-dihydroindol-1-yl)-1-propanone IUPAC Name: 3-(1,3-benzoxazol-2-ylsulfanyl)-1-(5-nitro-2,3-dihydroindol-1-yl)propan-1-one Traditional Name: 3-(1,3-benzoxazol-2-ylthio)-1-(5-nitroindolin-1-yl)propan-1-one Formula: C18H15N3O4S MolecularWeight: 369.3944

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(C2=C1C=C(C=C2)[N+](=O)[O-])C(=O)CCSC3=NC4=CC=CC=C4O3

Isomeric SMILES

C1CN(C2=C1C=C(C=C2)[N+](=O)[O-])C(=O)CCSC3=NC4=CC=CC=C4O3

InChI

InChI=1S/C18H15N3O4S/c22-17(8-10-26-18-19-14-3-1-2-4-16(14)25-18)20-9-7-12-11-13(21(23)24)5-6-15(12)20/h1-6,11H,7-10H2