8-methoxy-3-(methoxymethyl)-4-[4-(4-pyridin-2-ylpiperidin-1-yl)butyl]-1,4-benzoxazepin-5-one

Systemtic Name: 8-methoxy-3-(methoxymethyl)-4-[4-(4-pyridin-2-ylpiperidin-1-yl)butyl]-1,4-benzoxazepin-5-one Openeye Name: 8-methoxy-3-(methoxymethyl)-4-[4-[4-(2-pyridyl)-1-piperidyl]butyl]-1,4-benzoxazepin-5-one CAS Name: 8-methoxy-3-(methoxymethyl)-4-[4-[4-(2-pyridinyl)-1-piperidinyl]butyl]-1,4-benzoxazepin-5-one IUPAC Name: 8-methoxy-3-(methoxymethyl)-4-[4-(4-pyridin-2-ylpiperidin-1-yl)butyl]-1,4-benzoxazepin-5-one Traditional Name: 8-methoxy-3-(methoxymethyl)-4-[4-[4-(2-pyridyl)piperidino]butyl]-1,4-benzoxazepin-5-one Formula: C26H33N3O4 MolecularWeight: 451.55792

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Descriptors Computed from Structure

Canonical SMILES:

COCC1=COC2=C(C=CC(=C2)OC)C(=O)N1CCCCN3CCC(CC3)C4=CC=CC=N4

Isomeric SMILES

COCC1=COC2=C(C=CC(=C2)OC)C(=O)N1CCCCN3CCC(CC3)C4=CC=CC=N4

InChI

InChI=1S/C26H33N3O4/c1-31-18-21-19-33-25-17-22(32-2)8-9-23(25)26(30)29(21)14-6-5-13-28-15-10-20(11-16-28)24-7-3-4-12-27-24/h3-4,7-9,12,17,19-20H,5-6,10-11,13-16,18H2,1-2H3