2-[3-[[1-(2-ethoxy-2-oxidanylidene-ethyl)-2-oxidanylidene-5-phenyl-3H-1-benzazepin-3-yl]carbamoylamino]phenyl]ethanoic acid

Systemtic Name: 2-[3-[[1-(2-ethoxy-2-oxidanylidene-ethyl)-2-oxidanylidene-5-phenyl-3H-1-benzazepin-3-yl]carbamoylamino]phenyl]ethanoic acid Openeye Name: 2-[3-[[1-(2-ethoxy-2-oxo-ethyl)-2-oxo-5-phenyl-3H-1-benzazepin-3-yl]carbamoylamino]phenyl]acetic acid CAS Name: 2-[3-[[[[1-(2-ethoxy-2-oxoethyl)-2-oxo-5-phenyl-3H-1-benzazepin-3-yl]amino]-oxomethyl]amino]phenyl]acetic acid IUPAC Name: 2-[3-[[1-(2-ethoxy-2-oxoethyl)-2-oxo-5-phenyl-3H-1-benzazepin-3-yl]carbamoylamino]phenyl]acetic acid Traditional Name: 2-[3-[[1-(2-ethoxy-2-keto-ethyl)-2-keto-5-phenyl-3H-1-benzazepin-3-yl]carbamoylamino]phenyl]acetic acid Formula: C29H27N3O6 MolecularWeight: 513.54118

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CN1C2=CC=CC=C2C(=CC(C1=O)NC(=O)NC3=CC=CC(=C3)CC(=O)O)C4=CC=CC=C4

Isomeric SMILES

CCOC(=O)CN1C2=CC=CC=C2C(=CC(C1=O)NC(=O)NC3=CC=CC(=C3)CC(=O)O)C4=CC=CC=C4

InChI

InChI=1S/C29H27N3O6/c1-2-38-27(35)18-32-25-14-7-6-13-22(25)23(20-10-4-3-5-11-20)17-24(28(32)36)31-29(37)30-21-12-8-9-19(15-21)16-26(33)34/h3-15,17,24H,2,16,18H2,1H3,(H,33,34)(H2,30,31,37)