N-[2-[(2S)-2-phenyl-3,5-dihydro-2H-1,4-benzoxazepin-4-yl]ethyl]quinoxaline-5-carboxamide

Systemtic Name: N-[2-[(2S)-2-phenyl-3,5-dihydro-2H-1,4-benzoxazepin-4-yl]ethyl]quinoxaline-5-carboxamide Openeye Name: N-[2-[(2S)-2-phenyl-3,5-dihydro-2H-1,4-benzoxazepin-4-yl]ethyl]quinoxaline-5-carboxamide CAS Name: N-[2-[(2S)-2-phenyl-3,5-dihydro-2H-1,4-benzoxazepin-4-yl]ethyl]-5-quinoxalinecarboxamide IUPAC Name: N-[2-[(2S)-2-phenyl-3,5-dihydro-2H-1,4-benzoxazepin-4-yl]ethyl]quinoxaline-5-carboxamide Traditional Name: N-[2-[(2S)-2-phenyl-3,5-dihydro-2H-1,4-benzoxazepin-4-yl]ethyl]quinoxaline-5-carboxamide Formula: C26H24N4O2 MolecularWeight: 424.49436

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Descriptors Computed from Structure

Canonical SMILES:

C1C(OC2=CC=CC=C2CN1CCNC(=O)C3=C4C(=CC=C3)N=CC=N4)C5=CC=CC=C5

Isomeric SMILES

C1[C@@H](OC2=CC=CC=C2CN1CCNC(=O)C3=C4C(=CC=C3)N=CC=N4)C5=CC=CC=C5

InChI

InChI=1S/C26H24N4O2/c31-26(21-10-6-11-22-25(21)28-14-13-27-22)29-15-16-30-17-20-9-4-5-12-23(20)32-24(18-30)19-7-2-1-3-8-19/h1-14,24H,15-18H2,(H,29,31)/t24-/m1/s1