2-(1H-indazol-5-ylmethyl)-4-oxidanylidene-4-[4-(2-oxidanylidene-4,5-dihydro-1H-1,3-benzodiazepin-3-yl)piperidin-1-yl]butanoic acid

Systemtic Name: 2-(1H-indazol-5-ylmethyl)-4-oxidanylidene-4-[4-(2-oxidanylidene-4,5-dihydro-1H-1,3-benzodiazepin-3-yl)piperidin-1-yl]butanoic acid Openeye Name: 2-(1H-indazol-5-ylmethyl)-4-oxo-4-[4-(2-oxo-4,5-dihydro-1H-1,3-benzodiazepin-3-yl)-1-piperidyl]butanoic acid CAS Name: 2-(1H-indazol-5-ylmethyl)-4-oxo-4-[4-(2-oxo-4,5-dihydro-1H-1,3-benzodiazepin-3-yl)-1-piperidinyl]butanoic acid IUPAC Name: 2-(1H-indazol-5-ylmethyl)-4-oxo-4-[4-(2-oxo-4,5-dihydro-1H-1,3-benzodiazepin-3-yl)piperidin-1-yl]butanoic acid Traditional Name: 2-(1H-indazol-5-ylmethyl)-4-keto-4-[4-(2-keto-4,5-dihydro-1H-1,3-benzodiazepin-3-yl)piperidino]butyric acid Formula: C26H29N5O4 MolecularWeight: 475.53956

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1N2CCC3=CC=CC=C3NC2=O)C(=O)CC(CC4=CC5=C(C=C4)NN=C5)C(=O)O

Isomeric SMILES

C1CN(CCC1N2CCC3=CC=CC=C3NC2=O)C(=O)CC(CC4=CC5=C(C=C4)NN=C5)C(=O)O

InChI

InChI=1S/C26H29N5O4/c32-24(15-19(25(33)34)13-17-5-6-23-20(14-17)16-27-29-23)30-10-8-21(9-11-30)31-12-7-18-3-1-2-4-22(18)28-26(31)35/h1-6,14,16,19,21H,7-13,15H2,(H,27,29)(H,28,35)(H,33,34)