methyl 2-[[1-(2-ethoxy-2-oxidanylidene-ethyl)-2-oxidanylidene-4,5-dihydro-3H-1-benzazepin-3-yl]amino]-6-(phenylmethoxycarbonylamino)hexanoate

Systemtic Name: methyl 2-[[1-(2-ethoxy-2-oxidanylidene-ethyl)-2-oxidanylidene-4,5-dihydro-3H-1-benzazepin-3-yl]amino]-6-(phenylmethoxycarbonylamino)hexanoate Openeye Name: methyl 6-(benzyloxycarbonylamino)-2-[[1-(2-ethoxy-2-oxo-ethyl)-2-oxo-4,5-dihydro-3H-1-benzazepin-3-yl]amino]hexanoate CAS Name: 2-[[1-(2-ethoxy-2-oxoethyl)-2-oxo-4,5-dihydro-3H-1-benzazepin-3-yl]amino]-6-(phenylmethoxycarbonylamino)hexanoic acid methyl ester IUPAC Name: methyl 2-[[1-(2-ethoxy-2-oxoethyl)-2-oxo-4,5-dihydro-3H-1-benzazepin-3-yl]amino]-6-(phenylmethoxycarbonylamino)hexanoate Traditional Name: 6-(benzyloxycarbonylamino)-2-[[1-(2-ethoxy-2-keto-ethyl)-2-keto-4,5-dihydro-3H-1-benzazepin-3-yl]amino]hexanoic acid methyl ester Formula: C29H37N3O7 MolecularWeight: 539.61998

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CN1C2=CC=CC=C2CCC(C1=O)NC(CCCCNC(=O)OCC3=CC=CC=C3)C(=O)OC

Isomeric SMILES

CCOC(=O)CN1C2=CC=CC=C2CCC(C1=O)NC(CCCCNC(=O)OCC3=CC=CC=C3)C(=O)OC

InChI

InChI=1S/C29H37N3O7/c1-3-38-26(33)19-32-25-15-8-7-13-22(25)16-17-23(27(32)34)31-24(28(35)37-2)14-9-10-18-30-29(36)39-20-21-11-5-4-6-12-21/h4-8,11-13,15,23-24,31H,3,9-10,14,16-20H2,1-2H3,(H,30,36)