5-[[1-cyclohexyl-5-(3,3-dimethyl-2-oxidanylidene-butyl)-4-oxidanylidene-2,3-dihydro-1,5-benzodiazepin-3-yl]carbamoylamino]-2-methoxy-benzoic acid

Systemtic Name: 5-[[1-cyclohexyl-5-(3,3-dimethyl-2-oxidanylidene-butyl)-4-oxidanylidene-2,3-dihydro-1,5-benzodiazepin-3-yl]carbamoylamino]-2-methoxy-benzoic acid Openeye Name: 5-[[1-cyclohexyl-5-(3,3-dimethyl-2-oxo-butyl)-4-oxo-2,3-dihydro-1,5-benzodiazepin-3-yl]carbamoylamino]-2-methoxy-benzoic acid CAS Name: 5-[[[[1-cyclohexyl-5-(3,3-dimethyl-2-oxobutyl)-4-oxo-2,3-dihydro-1,5-benzodiazepin-3-yl]amino]-oxomethyl]amino]-2-methoxybenzoic acid IUPAC Name: 5-[[1-cyclohexyl-5-(3,3-dimethyl-2-oxobutyl)-4-oxo-2,3-dihydro-1,5-benzodiazepin-3-yl]carbamoylamino]-2-methoxybenzoic acid Traditional Name: 5-[[1-cyclohexyl-4-keto-5-(2-keto-3,3-dimethyl-butyl)-2,3-dihydro-1,5-benzodiazepin-3-yl]carbamoylamino]-2-methoxy-benzoic acid Formula: C30H38N4O6 MolecularWeight: 550.64592

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(=O)CN1C2=CC=CC=C2N(CC(C1=O)NC(=O)NC3=CC(=C(C=C3)OC)C(=O)O)C4CCCCC4

Isomeric SMILES

CC(C)(C)C(=O)CN1C2=CC=CC=C2N(CC(C1=O)NC(=O)NC3=CC(=C(C=C3)OC)C(=O)O)C4CCCCC4

InChI

InChI=1S/C30H38N4O6/c1-30(2,3)26(35)18-34-24-13-9-8-12-23(24)33(20-10-6-5-7-11-20)17-22(27(34)36)32-29(39)31-19-14-15-25(40-4)21(16-19)28(37)38/h8-9,12-16,20,22H,5-7,10-11,17-18H2,1-4H3,(H,37,38)(H2,31,32,39)