[(3R,4R)-4-azanyl-1-[(5-chloranyl-1-benzofuran-2-yl)carbonyl]pyrrolidin-3-yl]-pyrrolidin-1-yl-methanone

Systemtic Name: [(3R,4R)-4-azanyl-1-[(5-chloranyl-1-benzofuran-2-yl)carbonyl]pyrrolidin-3-yl]-pyrrolidin-1-yl-methanone Openeye Name: [(3R,4R)-4-amino-1-(5-chlorobenzofuran-2-carbonyl)pyrrolidin-3-yl]-pyrrolidin-1-yl-methanone CAS Name: [(3R,4R)-4-amino-1-[(5-chloro-2-benzofuranyl)-oxomethyl]-3-pyrrolidinyl]-(1-pyrrolidinyl)methanone IUPAC Name: [(3R,4R)-4-amino-1-(5-chloro-1-benzofuran-2-carbonyl)pyrrolidin-3-yl]-pyrrolidin-1-ylmethanone Traditional Name: [(3R,4R)-4-amino-1-(5-chlorobenzofuran-2-carbonyl)pyrrolidin-3-yl]-pyrrolidino-methanone Formula: C18H20ClN3O3 MolecularWeight: 361.8227

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C(=O)C2CN(CC2N)C(=O)C3=CC4=C(O3)C=CC(=C4)Cl

Isomeric SMILES

C1CCN(C1)C(=O)[C@@H]2CN(C[C@@H]2N)C(=O)C3=CC4=C(O3)C=CC(=C4)Cl

InChI

InChI=1S/C18H20ClN3O3/c19-12-3-4-15-11(7-12)8-16(25-15)18(24)22-9-13(14(20)10-22)17(23)21-5-1-2-6-21/h3-4,7-8,13-14H,1-2,5-6,9-10,20H2/t13-,14+/m1/s1