1-[7-(5-chloranyl-2-methoxy-phenyl)-9-methoxy-3,5-dihydro-2H-1,4-benzoxazepin-4-yl]-3-(2-methoxyphenyl)propan-1-one

Systemtic Name: 1-[7-(5-chloranyl-2-methoxy-phenyl)-9-methoxy-3,5-dihydro-2H-1,4-benzoxazepin-4-yl]-3-(2-methoxyphenyl)propan-1-one Openeye Name: 1-[7-(5-chloro-2-methoxy-phenyl)-9-methoxy-3,5-dihydro-2H-1,4-benzoxazepin-4-yl]-3-(2-methoxyphenyl)propan-1-one CAS Name: 1-[7-(5-chloro-2-methoxyphenyl)-9-methoxy-3,5-dihydro-2H-1,4-benzoxazepin-4-yl]-3-(2-methoxyphenyl)-1-propanone IUPAC Name: 1-[7-(5-chloro-2-methoxyphenyl)-9-methoxy-3,5-dihydro-2H-1,4-benzoxazepin-4-yl]-3-(2-methoxyphenyl)propan-1-one Traditional Name: 1-[7-(5-chloro-2-methoxy-phenyl)-9-methoxy-3,5-dihydro-2H-1,4-benzoxazepin-4-yl]-3-(2-methoxyphenyl)propan-1-one Formula: C27H28ClNO5 MolecularWeight: 481.96792

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)Cl)C2=CC3=C(C(=C2)OC)OCCN(C3)C(=O)CCC4=CC=CC=C4OC

Isomeric SMILES

COC1=C(C=C(C=C1)Cl)C2=CC3=C(C(=C2)OC)OCCN(C3)C(=O)CCC4=CC=CC=C4OC

InChI

InChI=1S/C27H28ClNO5/c1-31-23-7-5-4-6-18(23)8-11-26(30)29-12-13-34-27-20(17-29)14-19(15-25(27)33-3)22-16-21(28)9-10-24(22)32-2/h4-7,9-10,14-16H,8,11-13,17H2,1-3H3