2-[(2S)-2-(2-methoxyphenyl)-3,5-dihydro-2H-1,4-benzoxazepin-4-yl]-N-methyl-N-(quinoxalin-6-ylmethyl)ethanamide

Systemtic Name: 2-[(2S)-2-(2-methoxyphenyl)-3,5-dihydro-2H-1,4-benzoxazepin-4-yl]-N-methyl-N-(quinoxalin-6-ylmethyl)ethanamide Openeye Name: 2-[(2S)-2-(2-methoxyphenyl)-3,5-dihydro-2H-1,4-benzoxazepin-4-yl]-N-methyl-N-(quinoxalin-6-ylmethyl)acetamide CAS Name: 2-[(2S)-2-(2-methoxyphenyl)-3,5-dihydro-2H-1,4-benzoxazepin-4-yl]-N-methyl-N-(6-quinoxalinylmethyl)acetamide IUPAC Name: 2-[(2S)-2-(2-methoxyphenyl)-3,5-dihydro-2H-1,4-benzoxazepin-4-yl]-N-methyl-N-(quinoxalin-6-ylmethyl)acetamide Traditional Name: 2-[(2S)-2-(2-methoxyphenyl)-3,5-dihydro-2H-1,4-benzoxazepin-4-yl]-N-methyl-N-(quinoxalin-6-ylmethyl)acetamide Formula: C28H28N4O3 MolecularWeight: 468.54692

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CC2=NC=CN=C2C=C1)C(=O)CN3CC(OC4=CC=CC=C4C3)C5=CC=CC=C5OC

Isomeric SMILES

CN(CC1=CC2=NC=CN=C2C=C1)C(=O)CN3C[C@@H](OC4=CC=CC=C4C3)C5=CC=CC=C5OC

InChI

InChI=1S/C28H28N4O3/c1-31(16-20-11-12-23-24(15-20)30-14-13-29-23)28(33)19-32-17-21-7-3-5-9-25(21)35-27(18-32)22-8-4-6-10-26(22)34-2/h3-15,27H,16-19H2,1-2H3/t27-/m1/s1