N-[2-ethyl-4-(2-nitrophenyl)phenyl]-7-thia-9-azaspiro[4.4]non-8-en-8-amine

Systemtic Name: N-[2-ethyl-4-(2-nitrophenyl)phenyl]-7-thia-9-azaspiro[4.4]non-8-en-8-amine Openeye Name: N-[2-ethyl-4-(2-nitrophenyl)phenyl]-7-thia-9-azaspiro[4.4]non-8-en-8-amine CAS Name: N-[2-ethyl-4-(2-nitrophenyl)phenyl]-7-thia-9-azaspiro[4.4]non-8-en-8-amine IUPAC Name: N-[2-ethyl-4-(2-nitrophenyl)phenyl]-7-thia-9-azaspiro[4.4]non-8-en-8-amine Traditional Name: [2-ethyl-4-(2-nitrophenyl)phenyl]-(7-thia-9-azaspiro[4.4]non-8-en-8-yl)amine Formula: C21H23N3O2S MolecularWeight: 381.49122

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C=CC(=C1)C2=CC=CC=C2[N+](=O)[O-])NC3=NC4(CCCC4)CS3

Isomeric SMILES

CCC1=C(C=CC(=C1)C2=CC=CC=C2[N+](=O)[O-])NC3=NC4(CCCC4)CS3

InChI

InChI=1S/C21H23N3O2S/c1-2-15-13-16(17-7-3-4-8-19(17)24(25)26)9-10-18(15)22-20-23-21(14-27-20)11-5-6-12-21/h3-4,7-10,13H,2,5-6,11-12,14H2,1H3,(H,22,23)