3-[(2S)-2-ethyl-7-methoxy-3,5-dihydro-2H-1,4-benzoxazepin-4-yl]-1-[(3R)-3-propanoylpiperidin-1-yl]propan-1-one

Systemtic Name: 3-[(2S)-2-ethyl-7-methoxy-3,5-dihydro-2H-1,4-benzoxazepin-4-yl]-1-[(3R)-3-propanoylpiperidin-1-yl]propan-1-one Openeye Name: 3-[(2S)-2-ethyl-7-methoxy-3,5-dihydro-2H-1,4-benzoxazepin-4-yl]-1-[(3R)-3-propanoyl-1-piperidyl]propan-1-one CAS Name: 3-[(2S)-2-ethyl-7-methoxy-3,5-dihydro-2H-1,4-benzoxazepin-4-yl]-1-[(3R)-3-(1-oxopropyl)-1-piperidinyl]-1-propanone IUPAC Name: 3-[(2S)-2-ethyl-7-methoxy-3,5-dihydro-2H-1,4-benzoxazepin-4-yl]-1-[(3R)-3-propanoylpiperidin-1-yl]propan-1-one Traditional Name: 3-[(2S)-2-ethyl-7-methoxy-3,5-dihydro-2H-1,4-benzoxazepin-4-yl]-1-[(3R)-3-propionylpiperidino]propan-1-one Formula: C23H34N2O4 MolecularWeight: 402.52706

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Descriptors Computed from Structure

Canonical SMILES:

CCC1CN(CC2=C(O1)C=CC(=C2)OC)CCC(=O)N3CCCC(C3)C(=O)CC

Isomeric SMILES

CC[C@H]1CN(CC2=C(O1)C=CC(=C2)OC)CCC(=O)N3CCC[C@H](C3)C(=O)CC

InChI

InChI=1S/C23H34N2O4/c1-4-19-16-24(14-18-13-20(28-3)8-9-22(18)29-19)12-10-23(27)25-11-6-7-17(15-25)21(26)5-2/h8-9,13,17,19H,4-7,10-12,14-16H2,1-3H3/t17-,19+/m1/s1