(E)-N-[2-[(2S)-2-butyl-3,5-dihydro-2H-1,4-benzoxazepin-4-yl]ethyl]-3-pyridin-4-yl-prop-2-enamide

Systemtic Name: (E)-N-[2-[(2S)-2-butyl-3,5-dihydro-2H-1,4-benzoxazepin-4-yl]ethyl]-3-pyridin-4-yl-prop-2-enamide Openeye Name: (E)-N-[2-[(2S)-2-butyl-3,5-dihydro-2H-1,4-benzoxazepin-4-yl]ethyl]-3-(4-pyridyl)prop-2-enamide CAS Name: (E)-N-[2-[(2S)-2-butyl-3,5-dihydro-2H-1,4-benzoxazepin-4-yl]ethyl]-3-pyridin-4-yl-2-propenamide IUPAC Name: (E)-N-[2-[(2S)-2-butyl-3,5-dihydro-2H-1,4-benzoxazepin-4-yl]ethyl]-3-pyridin-4-ylprop-2-enamide Traditional Name: (E)-N-[2-[(2S)-2-butyl-3,5-dihydro-2H-1,4-benzoxazepin-4-yl]ethyl]-3-(4-pyridyl)acrylamide Formula: C23H29N3O2 MolecularWeight: 379.49526

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1CN(CC2=CC=CC=C2O1)CCNC(=O)C=CC3=CC=NC=C3

Isomeric SMILES

CCCC[C@H]1CN(CC2=CC=CC=C2O1)CCNC(=O)/C=C/C3=CC=NC=C3

InChI

InChI=1S/C23H29N3O2/c1-2-3-7-21-18-26(17-20-6-4-5-8-22(20)28-21)16-15-25-23(27)10-9-19-11-13-24-14-12-19/h4-6,8-14,21H,2-3,7,15-18H2,1H3,(H,25,27)/b10-9+/t21-/m0/s1