2-(2-methanoyl-4-nitro-phenyl)sulfanyl-5,6,7,8,9,10-hexahydrocycloocta[b]pyridine-3-carbonitrile

Systemtic Name: 2-(2-methanoyl-4-nitro-phenyl)sulfanyl-5,6,7,8,9,10-hexahydrocycloocta[b]pyridine-3-carbonitrile Openeye Name: 2-(2-formyl-4-nitro-phenyl)sulfanyl-5,6,7,8,9,10-hexahydrocycloocta[b]pyridine-3-carbonitrile CAS Name: 2-[(2-formyl-4-nitrophenyl)thio]-5,6,7,8,9,10-hexahydrocycloocta[b]pyridine-3-carbonitrile IUPAC Name: 2-(2-formyl-4-nitrophenyl)sulfanyl-5,6,7,8,9,10-hexahydrocycloocta[b]pyridine-3-carbonitrile Traditional Name: 2-[(2-formyl-4-nitro-phenyl)thio]-5,6,7,8,9,10-hexahydrocycloocta[b]pyridine-3-carbonitrile Formula: C19H17N3O3S MolecularWeight: 367.42158

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCC2=C(CC1)C=C(C(=N2)SC3=C(C=C(C=C3)[N+](=O)[O-])C=O)C#N

Isomeric SMILES

C1CCCC2=C(CC1)C=C(C(=N2)SC3=C(C=C(C=C3)[N+](=O)[O-])C=O)C#N

InChI

InChI=1S/C19H17N3O3S/c20-11-14-9-13-5-3-1-2-4-6-17(13)21-19(14)26-18-8-7-16(22(24)25)10-15(18)12-23/h7-10,12H,1-6H2