2-[methoxycarbonyl-[2-(5-thiophen-3-ylfuran-2-yl)ethyl]amino]-4-methyl-pentanoic acid

Systemtic Name: 2-[methoxycarbonyl-[2-(5-thiophen-3-ylfuran-2-yl)ethyl]amino]-4-methyl-pentanoic acid Openeye Name: 2-[methoxycarbonyl-[2-[5-(3-thienyl)-2-furyl]ethyl]amino]-4-methyl-pentanoic acid CAS Name: 2-[methoxycarbonyl-[2-[5-(3-thiophenyl)-2-furanyl]ethyl]amino]-4-methylpentanoic acid IUPAC Name: 2-[methoxycarbonyl-[2-(5-thiophen-3-ylfuran-2-yl)ethyl]amino]-4-methylpentanoic acid Traditional Name: 2-[carbomethoxy-[2-[5-(3-thienyl)-2-furyl]ethyl]amino]-4-methyl-valeric acid Formula: C18H23NO5S MolecularWeight: 365.44392

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)O)N(CCC1=CC=C(O1)C2=CSC=C2)C(=O)OC

Isomeric SMILES

CC(C)CC(C(=O)O)N(CCC1=CC=C(O1)C2=CSC=C2)C(=O)OC

InChI

InChI=1S/C18H23NO5S/c1-12(2)10-15(17(20)21)19(18(22)23-3)8-6-14-4-5-16(24-14)13-7-9-25-11-13/h4-5,7,9,11-12,15H,6,8,10H2,1-3H3,(H,20,21)