(2-chloranyl-3-nitro-phenyl)-[7-ethyl-1-(3-methylsulfanylpropyl)indol-3-yl]methanone

Systemtic Name: (2-chloranyl-3-nitro-phenyl)-[7-ethyl-1-(3-methylsulfanylpropyl)indol-3-yl]methanone Openeye Name: (2-chloro-3-nitro-phenyl)-[7-ethyl-1-(3-methylsulfanylpropyl)indol-3-yl]methanone CAS Name: (2-chloro-3-nitrophenyl)-[7-ethyl-1-[3-(methylthio)propyl]-3-indolyl]methanone IUPAC Name: (2-chloro-3-nitrophenyl)-[7-ethyl-1-(3-methylsulfanylpropyl)indol-3-yl]methanone Traditional Name: (2-chloro-3-nitro-phenyl)-[7-ethyl-1-[3-(methylthio)propyl]indol-3-yl]methanone Formula: C21H21ClN2O3S MolecularWeight: 416.92104

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC2=C1N(C=C2C(=O)C3=C(C(=CC=C3)[N+](=O)[O-])Cl)CCCSC

Isomeric SMILES

CCC1=CC=CC2=C1N(C=C2C(=O)C3=C(C(=CC=C3)[N+](=O)[O-])Cl)CCCSC

InChI

InChI=1S/C21H21ClN2O3S/c1-3-14-7-4-8-15-17(13-23(20(14)15)11-6-12-28-2)21(25)16-9-5-10-18(19(16)22)24(26)27/h4-5,7-10,13H,3,6,11-12H2,1-2H3