2-[(3S)-3-[[(2S)-1-ethoxy-1-oxidanylidene-pentan-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-pentan-2-yl]amino]-2-oxidanylidene-4,5-dihydro-3H-1-benzazepin-1-yl]ethanoic acid Openeye Name: 2-[(3S)-3-[[(1S)-1-ethoxycarbonylbutyl]amino]-2-oxo-4,5-dihydro-3H-1-benzazepin-1-yl]acetic acid CAS Name: 2-[(3S)-3-[[(2S)-1-ethoxy-1-oxopentan-2-yl]amino]-2-oxo-4,5-dihydro-3H-1-benzazepin-1-yl]acetic acid IUPAC Name: 2-[(3S)-3-[[(2S)-1-ethoxy-1-oxopentan-2-yl]amino]-2-oxo-4,5-dihydro-3H-1-benzazepin-1-yl]acetic acid Traditional Name: 2-[(3S)-3-[[(1S)-1-carbethoxybutyl]amino]-2-keto-4,5-dihydro-3H-1-benzazepin-1-yl]acetic acid Formula: C19H26N2O5 MolecularWeight: 362.42014

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C(=O)OCC)NC1CCC2=CC=CC=C2N(C1=O)CC(=O)O

Isomeric SMILES

CCC[C@@H](C(=O)OCC)N[C@H]1CCC2=CC=CC=C2N(C1=O)CC(=O)O

InChI

InChI=1S/C19H26N2O5/c1-3-7-15(19(25)26-4-2)20-14-11-10-13-8-5-6-9-16(13)21(18(14)24)12-17(22)23/h5-6,8-9,14-15,20H,3-4,7,10-12H2,1-2H3,(H,22,23)/t14-,15-/m0/s1