4-[cycloheptyl(thiophen-2-ylmethyl)amino]-4-oxidanylidene-butanoic acid

Systemtic Name: 4-[cycloheptyl(thiophen-2-ylmethyl)amino]-4-oxidanylidene-butanoic acid Openeye Name: 4-[cycloheptyl(2-thienylmethyl)amino]-4-oxo-butanoic acid CAS Name: 4-[cycloheptyl(thiophen-2-ylmethyl)amino]-4-oxobutanoic acid IUPAC Name: 4-[cycloheptyl(thiophen-2-ylmethyl)amino]-4-oxobutanoic acid Traditional Name: 4-[cycloheptyl(2-thenyl)amino]-4-keto-butyric acid Formula: C16H23NO3S MolecularWeight: 309.42372

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCC(CC1)N(CC2=CC=CS2)C(=O)CCC(=O)O

Isomeric SMILES

C1CCCC(CC1)N(CC2=CC=CS2)C(=O)CCC(=O)O

InChI

InChI=1S/C16H23NO3S/c18-15(9-10-16(19)20)17(12-14-8-5-11-21-14)13-6-3-1-2-4-7-13/h5,8,11,13H,1-4,6-7,9-10,12H2,(H,19,20)