[5-(morpholin-4-ylmethyl)-2-oxidanylidene-1-(2-oxidanylidene-2-pyrrolidin-1-yl-ethyl)-3H-1,4-benzodiazepin-3-yl]carbamic acid

Systemtic Name: [5-(morpholin-4-ylmethyl)-2-oxidanylidene-1-(2-oxidanylidene-2-pyrrolidin-1-yl-ethyl)-3H-1,4-benzodiazepin-3-yl]carbamic acid Openeye Name: [5-(morpholinomethyl)-2-oxo-1-(2-oxo-2-pyrrolidin-1-yl-ethyl)-3H-1,4-benzodiazepin-3-yl]carbamic acid CAS Name: [5-(4-morpholinylmethyl)-2-oxo-1-[2-oxo-2-(1-pyrrolidinyl)ethyl]-3H-1,4-benzodiazepin-3-yl]carbamic acid IUPAC Name: [5-(morpholin-4-ylmethyl)-2-oxo-1-(2-oxo-2-pyrrolidin-1-ylethyl)-3H-1,4-benzodiazepin-3-yl]carbamic acid Traditional Name: [2-keto-1-(2-keto-2-pyrrolidino-ethyl)-5-(morpholinomethyl)-3H-1,4-benzodiazepin-3-yl]carbamic acid Formula: C21H27N5O5 MolecularWeight: 429.46958

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C(=O)CN2C3=CC=CC=C3C(=NC(C2=O)NC(=O)O)CN4CCOCC4

Isomeric SMILES

C1CCN(C1)C(=O)CN2C3=CC=CC=C3C(=NC(C2=O)NC(=O)O)CN4CCOCC4

InChI

InChI=1S/C21H27N5O5/c27-18(25-7-3-4-8-25)14-26-17-6-2-1-5-15(17)16(13-24-9-11-31-12-10-24)22-19(20(26)28)23-21(29)30/h1-2,5-6,19,23H,3-4,7-14H2,(H,29,30)