(2S)-2-ethyl-7-methoxy-4-(pyridin-3-ylmethyl)-3,5-dihydro-2H-1,4-benzoxazepine

Systemtic Name: (2S)-2-ethyl-7-methoxy-4-(pyridin-3-ylmethyl)-3,5-dihydro-2H-1,4-benzoxazepine Openeye Name: (2S)-2-ethyl-7-methoxy-4-(3-pyridylmethyl)-3,5-dihydro-2H-1,4-benzoxazepine CAS Name: (2S)-2-ethyl-7-methoxy-4-(3-pyridinylmethyl)-3,5-dihydro-2H-1,4-benzoxazepine IUPAC Name: (2S)-2-ethyl-7-methoxy-4-(pyridin-3-ylmethyl)-3,5-dihydro-2H-1,4-benzoxazepine Traditional Name: (2S)-2-ethyl-7-methoxy-4-(3-pyridylmethyl)-3,5-dihydro-2H-1,4-benzoxazepine Formula: C18H22N2O2 MolecularWeight: 298.37948

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Descriptors Computed from Structure

Canonical SMILES:

CCC1CN(CC2=C(O1)C=CC(=C2)OC)CC3=CN=CC=C3

Isomeric SMILES

CC[C@H]1CN(CC2=C(O1)C=CC(=C2)OC)CC3=CN=CC=C3

InChI

InChI=1S/C18H22N2O2/c1-3-16-13-20(11-14-5-4-8-19-10-14)12-15-9-17(21-2)6-7-18(15)22-16/h4-10,16H,3,11-13H2,1-2H3/t16-/m0/s1