5-[(3-cyano-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophen-2-yl)amino]-3,3-dimethyl-5-oxidanylidene-pentanoate

Systemtic Name: 5-[(3-cyano-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophen-2-yl)amino]-3,3-dimethyl-5-oxidanylidene-pentanoate Openeye Name: 5-[(3-cyano-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophen-2-yl)amino]-3,3-dimethyl-5-oxo-pentanoate CAS Name: 5-[(3-cyano-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophen-2-yl)amino]-3,3-dimethyl-5-oxopentanoate IUPAC Name: 5-[(3-cyano-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophen-2-yl)amino]-3,3-dimethyl-5-oxopentanoate Traditional Name: 5-[(3-cyano-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophen-2-yl)amino]-5-keto-3,3-dimethyl-valerate Formula: C17H21N2O3S- MolecularWeight: 333.42524

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H22N2O3S/c1-17(2,9-15(21)22)8-14(20)19-16-12(10-18)11-6-4-3-5-7-13(11)23-16/h3-9H2,1-2H3,(H,19,20)(H,21,22)/p-1