2-(pentanoylamino)-4-(5,6,7,8-tetrahydronaphthalen-2-yl)thiophene-3-carboxylate

Systemtic Name: 2-(pentanoylamino)-4-(5,6,7,8-tetrahydronaphthalen-2-yl)thiophene-3-carboxylate Openeye Name: 2-(pentanoylamino)-4-tetralin-6-yl-thiophene-3-carboxylate CAS Name: 2-(1-oxopentylamino)-4-(5,6,7,8-tetrahydronaphthalen-2-yl)-3-thiophenecarboxylate IUPAC Name: 2-(pentanoylamino)-4-(5,6,7,8-tetrahydronaphthalen-2-yl)thiophene-3-carboxylate Traditional Name: 4-tetralin-6-yl-2-(valerylamino)-3-thenoate Formula: C20H22NO3S- MolecularWeight: 356.45858

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(=O)NC1=C(C(=CS1)C2=CC3=C(CCCC3)C=C2)C(=O)[O-]

Isomeric SMILES

CCCCC(=O)NC1=C(C(=CS1)C2=CC3=C(CCCC3)C=C2)C(=O)[O-]

InChI

InChI=1S/C20H23NO3S/c1-2-3-8-17(22)21-19-18(20(23)24)16(12-25-19)15-10-9-13-6-4-5-7-14(13)11-15/h9-12H,2-8H2,1H3,(H,21,22)(H,23,24)/p-1