4-[4-[4-(6-chloranylpyridin-2-yl)-3,6-dihydro-2H-pyridin-1-yl]butyl]-3-(methoxymethyl)-1,4-benzoxazepin-5-one

Systemtic Name: 4-[4-[4-(6-chloranylpyridin-2-yl)-3,6-dihydro-2H-pyridin-1-yl]butyl]-3-(methoxymethyl)-1,4-benzoxazepin-5-one Openeye Name: 4-[4-[4-(6-chloro-2-pyridyl)-3,6-dihydro-2H-pyridin-1-yl]butyl]-3-(methoxymethyl)-1,4-benzoxazepin-5-one CAS Name: 4-[4-[4-(6-chloro-2-pyridinyl)-3,6-dihydro-2H-pyridin-1-yl]butyl]-3-(methoxymethyl)-1,4-benzoxazepin-5-one IUPAC Name: 4-[4-[4-(6-chloropyridin-2-yl)-3,6-dihydro-2H-pyridin-1-yl]butyl]-3-(methoxymethyl)-1,4-benzoxazepin-5-one Traditional Name: 4-[4-[4-(6-chloro-2-pyridyl)-3,6-dihydro-2H-pyridin-1-yl]butyl]-3-(methoxymethyl)-1,4-benzoxazepin-5-one Formula: C25H28ClN3O3 MolecularWeight: 453.96112

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Descriptors Computed from Structure

Canonical SMILES:

COCC1=COC2=CC=CC=C2C(=O)N1CCCCN3CCC(=CC3)C4=NC(=CC=C4)Cl

Isomeric SMILES

COCC1=COC2=CC=CC=C2C(=O)N1CCCCN3CCC(=CC3)C4=NC(=CC=C4)Cl

InChI

InChI=1S/C25H28ClN3O3/c1-31-17-20-18-32-23-9-3-2-7-21(23)25(30)29(20)14-5-4-13-28-15-11-19(12-16-28)22-8-6-10-24(26)27-22/h2-3,6-11,18H,4-5,12-17H2,1H3