tert-butyl 2-[[2-methyl-4-(2,3,4,5-tetrahydro-1-benzazepin-1-ylcarbonyl)phenyl]methylcarbamoylamino]ethanoate

Systemtic Name: tert-butyl 2-[[2-methyl-4-(2,3,4,5-tetrahydro-1-benzazepin-1-ylcarbonyl)phenyl]methylcarbamoylamino]ethanoate Openeye Name: tert-butyl 2-[[2-methyl-4-(2,3,4,5-tetrahydro-1-benzazepine-1-carbonyl)phenyl]methylcarbamoylamino]acetate CAS Name: 2-[[[[2-methyl-4-[oxo(2,3,4,5-tetrahydro-1-benzazepin-1-yl)methyl]phenyl]methylamino]-oxomethyl]amino]acetic acid tert-butyl ester IUPAC Name: tert-butyl 2-[[2-methyl-4-(2,3,4,5-tetrahydro-1-benzazepine-1-carbonyl)phenyl]methylcarbamoylamino]acetate Traditional Name: 2-[[2-methyl-4-(2,3,4,5-tetrahydro-1-benzazepine-1-carbonyl)benzyl]carbamoylamino]acetic acid tert-butyl ester Formula: C26H33N3O4 MolecularWeight: 451.55792

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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)OC(C)(C)C

Isomeric SMILES

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

InChI

InChI=1S/C26H33N3O4/c1-18-15-20(24(31)29-14-8-7-10-19-9-5-6-11-22(19)29)12-13-21(18)16-27-25(32)28-17-23(30)33-26(2,3)4/h5-6,9,11-13,15H,7-8,10,14,16-17H2,1-4H3,(H2,27,28,32)