ethyl 2-[3-[[2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-phenyl-propanoyl]amino]-2-oxidanylidene-5-phenyl-3H-1-benzazepin-1-yl]ethanoate

Systemtic Name: ethyl 2-[3-[[2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-phenyl-propanoyl]amino]-2-oxidanylidene-5-phenyl-3H-1-benzazepin-1-yl]ethanoate Openeye Name: ethyl 2-[3-[[2-(tert-butoxycarbonylamino)-3-phenyl-propanoyl]amino]-2-oxo-5-phenyl-3H-1-benzazepin-1-yl]acetate CAS Name: 2-[3-[[2-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-1-oxo-3-phenylpropyl]amino]-2-oxo-5-phenyl-3H-1-benzazepin-1-yl]acetic acid ethyl ester IUPAC Name: ethyl 2-[3-[[2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-phenylpropanoyl]amino]-2-oxo-5-phenyl-3H-1-benzazepin-1-yl]acetate Traditional Name: 2-[3-[[2-(tert-butoxycarbonylamino)-3-phenyl-propanoyl]amino]-2-keto-5-phenyl-3H-1-benzazepin-1-yl]acetic acid ethyl ester Formula: C34H37N3O6 MolecularWeight: 583.67408

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CN1C2=CC=CC=C2C(=CC(C1=O)NC(=O)C(CC3=CC=CC=C3)NC(=O)OC(C)(C)C)C4=CC=CC=C4

Isomeric SMILES

CCOC(=O)CN1C2=CC=CC=C2C(=CC(C1=O)NC(=O)C(CC3=CC=CC=C3)NC(=O)OC(C)(C)C)C4=CC=CC=C4

InChI

InChI=1S/C34H37N3O6/c1-5-42-30(38)22-37-29-19-13-12-18-25(29)26(24-16-10-7-11-17-24)21-28(32(37)40)35-31(39)27(20-23-14-8-6-9-15-23)36-33(41)43-34(2,3)4/h6-19,21,27-28H,5,20,22H2,1-4H3,(H,35,39)(H,36,41)