N-(3-cyano-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophen-2-yl)-2-(2-nitrophenoxy)propanamide

Systemtic Name: N-(3-cyano-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophen-2-yl)-2-(2-nitrophenoxy)propanamide Openeye Name: N-(3-cyano-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophen-2-yl)-2-(2-nitrophenoxy)propanamide CAS Name: N-(3-cyano-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophen-2-yl)-2-(2-nitrophenoxy)propanamide IUPAC Name: N-(3-cyano-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophen-2-yl)-2-(2-nitrophenoxy)propanamide Traditional Name: N-(3-cyano-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophen-2-yl)-2-(2-nitrophenoxy)propionamide Formula: C19H19N3O4S MolecularWeight: 385.43686

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=C(C2=C(S1)CCCCC2)C#N)OC3=CC=CC=C3[N+](=O)[O-]

Isomeric SMILES

CC(C(=O)NC1=C(C2=C(S1)CCCCC2)C#N)OC3=CC=CC=C3[N+](=O)[O-]

InChI

InChI=1S/C19H19N3O4S/c1-12(26-16-9-6-5-8-15(16)22(24)25)18(23)21-19-14(11-20)13-7-3-2-4-10-17(13)27-19/h5-6,8-9,12H,2-4,7,10H2,1H3,(H,21,23)