1-(2-benzamido-3-methyl-pent-2-enoyl)pyrrolidine-2-carboxylic acid

Systemtic Name: 1-(2-benzamido-3-methyl-pent-2-enoyl)pyrrolidine-2-carboxylic acid Openeye Name: 1-(2-benzamido-3-methyl-pent-2-enoyl)pyrrolidine-2-carboxylic acid CAS Name: 1-(2-benzamido-3-methyl-1-oxopent-2-enyl)-2-pyrrolidinecarboxylic acid IUPAC Name: 1-(2-benzamido-3-methylpent-2-enoyl)pyrrolidine-2-carboxylic acid Traditional Name: 1-(2-benzamido-3-methyl-pent-2-enoyl)proline Formula: C18H22N2O4 MolecularWeight: 330.37828

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=C(C(=O)N1CCCC1C(=O)O)NC(=O)C2=CC=CC=C2)C

Isomeric SMILES

CCC(=C(C(=O)N1CCCC1C(=O)O)NC(=O)C2=CC=CC=C2)C

InChI

InChI=1S/C18H22N2O4/c1-3-12(2)15(19-16(21)13-8-5-4-6-9-13)17(22)20-11-7-10-14(20)18(23)24/h4-6,8-9,14H,3,7,10-11H2,1-2H3,(H,19,21)(H,23,24)