2-[[5-(carboxymethyl)-1-methyl-4-oxidanylidene-2,3-dihydro-1,5-benzodiazepin-3-yl]amino]-4-phenyl-butanoic acid

Systemtic Name: 2-[[5-(carboxymethyl)-1-methyl-4-oxidanylidene-2,3-dihydro-1,5-benzodiazepin-3-yl]amino]-4-phenyl-butanoic acid Openeye Name: 2-[[5-(carboxymethyl)-1-methyl-4-oxo-2,3-dihydro-1,5-benzodiazepin-3-yl]amino]-4-phenyl-butanoic acid CAS Name: 2-[[5-(carboxymethyl)-1-methyl-4-oxo-2,3-dihydro-1,5-benzodiazepin-3-yl]amino]-4-phenylbutanoic acid IUPAC Name: 2-[[5-(carboxymethyl)-1-methyl-4-oxo-2,3-dihydro-1,5-benzodiazepin-3-yl]amino]-4-phenylbutanoic acid Traditional Name: 2-[[5-(carboxymethyl)-4-keto-1-methyl-2,3-dihydro-1,5-benzodiazepin-3-yl]amino]-4-phenyl-butyric acid Formula: C22H25N3O5 MolecularWeight: 411.451

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Descriptors Computed from Structure

Canonical SMILES:

CN1CC(C(=O)N(C2=CC=CC=C21)CC(=O)O)NC(CCC3=CC=CC=C3)C(=O)O

Isomeric SMILES

CN1CC(C(=O)N(C2=CC=CC=C21)CC(=O)O)NC(CCC3=CC=CC=C3)C(=O)O

InChI

InChI=1S/C22H25N3O5/c1-24-13-17(23-16(22(29)30)12-11-15-7-3-2-4-8-15)21(28)25(14-20(26)27)19-10-6-5-9-18(19)24/h2-10,16-17,23H,11-14H2,1H3,(H,26,27)(H,29,30)