2-[[2-methyl-4-(2,3,4,5-tetrahydro-1-benzazepin-1-ylcarbonyl)phenyl]methylcarbamoylamino]ethanoic acid

Systemtic Name: 2-[[2-methyl-4-(2,3,4,5-tetrahydro-1-benzazepin-1-ylcarbonyl)phenyl]methylcarbamoylamino]ethanoic acid Openeye Name: 2-[[2-methyl-4-(2,3,4,5-tetrahydro-1-benzazepine-1-carbonyl)phenyl]methylcarbamoylamino]acetic acid CAS Name: 2-[[[[2-methyl-4-[oxo(2,3,4,5-tetrahydro-1-benzazepin-1-yl)methyl]phenyl]methylamino]-oxomethyl]amino]acetic acid IUPAC Name: 2-[[2-methyl-4-(2,3,4,5-tetrahydro-1-benzazepine-1-carbonyl)phenyl]methylcarbamoylamino]acetic acid Traditional Name: 2-[[2-methyl-4-(2,3,4,5-tetrahydro-1-benzazepine-1-carbonyl)benzyl]carbamoylamino]acetic acid Formula: C22H25N3O4 MolecularWeight: 395.4516

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)C(=O)N2CCCCC3=CC=CC=C32)CNC(=O)NCC(=O)O

Isomeric SMILES

CC1=C(C=CC(=C1)C(=O)N2CCCCC3=CC=CC=C32)CNC(=O)NCC(=O)O

InChI

InChI=1S/C22H25N3O4/c1-15-12-17(9-10-18(15)13-23-22(29)24-14-20(26)27)21(28)25-11-5-4-7-16-6-2-3-8-19(16)25/h2-3,6,8-10,12H,4-5,7,11,13-14H2,1H3,(H,26,27)(H2,23,24,29)