(3-azanylidene-2,2-dimethyl-3-thiophen-2-yl-propyl) 4-methoxybenzoate

Systemtic Name: (3-azanylidene-2,2-dimethyl-3-thiophen-2-yl-propyl) 4-methoxybenzoate Openeye Name: [3-imino-2,2-dimethyl-3-(2-thienyl)propyl] 4-methoxybenzoate CAS Name: 4-methoxybenzoic acid (3-imino-2,2-dimethyl-3-thiophen-2-ylpropyl) ester IUPAC Name: (3-imino-2,2-dimethyl-3-thiophen-2-ylpropyl) 4-methoxybenzoate Traditional Name: 4-methoxybenzoic acid [3-imino-2,2-dimethyl-3-(2-thienyl)propyl] ester Formula: C17H19NO3S MolecularWeight: 317.40266

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(COC(=O)C1=CC=C(C=C1)OC)C(=N)C2=CC=CS2

Isomeric SMILES

CC(C)(COC(=O)C1=CC=C(C=C1)OC)C(=N)C2=CC=CS2

InChI

InChI=1S/C17H19NO3S/c1-17(2,15(18)14-5-4-10-22-14)11-21-16(19)12-6-8-13(20-3)9-7-12/h4-10,18H,11H2,1-3H3