2-[(3S)-3-[[(2S)-1-ethoxy-1-oxidanylidene-3-phenylmethoxy-propan-2-yl]amino]-2-oxidanylidene-4,5-dihydro-3H-1-benzazepin-1-yl]ethanoic acid

Systemtic Name: 2-[(3S)-3-[[(2S)-1-ethoxy-1-oxidanylidene-3-phenylmethoxy-propan-2-yl]amino]-2-oxidanylidene-4,5-dihydro-3H-1-benzazepin-1-yl]ethanoic acid Openeye Name: 2-[(3S)-3-[[(1S)-1-(benzyloxymethyl)-2-ethoxy-2-oxo-ethyl]amino]-2-oxo-4,5-dihydro-3H-1-benzazepin-1-yl]acetic acid CAS Name: 2-[(3S)-3-[[(2S)-1-ethoxy-1-oxo-3-phenylmethoxypropan-2-yl]amino]-2-oxo-4,5-dihydro-3H-1-benzazepin-1-yl]acetic acid IUPAC Name: 2-[(3S)-3-[[(2S)-1-ethoxy-1-oxo-3-phenylmethoxypropan-2-yl]amino]-2-oxo-4,5-dihydro-3H-1-benzazepin-1-yl]acetic acid Traditional Name: 2-[(3S)-3-[[(1S)-1-(benzoxymethyl)-2-ethoxy-2-keto-ethyl]amino]-2-keto-4,5-dihydro-3H-1-benzazepin-1-yl]acetic acid Formula: C24H28N2O6 MolecularWeight: 440.48892

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(COCC1=CC=CC=C1)NC2CCC3=CC=CC=C3N(C2=O)CC(=O)O

Isomeric SMILES

CCOC(=O)[C@H](COCC1=CC=CC=C1)N[C@H]2CCC3=CC=CC=C3N(C2=O)CC(=O)O

InChI

InChI=1S/C24H28N2O6/c1-2-32-24(30)20(16-31-15-17-8-4-3-5-9-17)25-19-13-12-18-10-6-7-11-21(18)26(23(19)29)14-22(27)28/h3-11,19-20,25H,2,12-16H2,1H3,(H,27,28)/t19-,20-/m0/s1