4-(cyclohexylmethyl)-9-methoxy-7-pyridin-3-yl-3,5-dihydro-2H-1,4-benzoxazepine

Systemtic Name: 4-(cyclohexylmethyl)-9-methoxy-7-pyridin-3-yl-3,5-dihydro-2H-1,4-benzoxazepine Openeye Name: 4-(cyclohexylmethyl)-9-methoxy-7-(3-pyridyl)-3,5-dihydro-2H-1,4-benzoxazepine CAS Name: 4-(cyclohexylmethyl)-9-methoxy-7-(3-pyridinyl)-3,5-dihydro-2H-1,4-benzoxazepine IUPAC Name: 4-(cyclohexylmethyl)-9-methoxy-7-pyridin-3-yl-3,5-dihydro-2H-1,4-benzoxazepine Traditional Name: 4-(cyclohexylmethyl)-9-methoxy-7-(3-pyridyl)-3,5-dihydro-2H-1,4-benzoxazepine Formula: C22H28N2O2 MolecularWeight: 352.46992

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC2=C1OCCN(C2)CC3CCCCC3)C4=CN=CC=C4

Isomeric SMILES

COC1=CC(=CC2=C1OCCN(C2)CC3CCCCC3)C4=CN=CC=C4

InChI

InChI=1S/C22H28N2O2/c1-25-21-13-19(18-8-5-9-23-14-18)12-20-16-24(10-11-26-22(20)21)15-17-6-3-2-4-7-17/h5,8-9,12-14,17H,2-4,6-7,10-11,15-16H2,1H3