7-methoxy-3-(methoxymethyl)-4-[4-[4-(2-methoxyphenyl)piperazin-1-yl]butyl]-1,4-benzoxazepin-5-one

Systemtic Name: 7-methoxy-3-(methoxymethyl)-4-[4-[4-(2-methoxyphenyl)piperazin-1-yl]butyl]-1,4-benzoxazepin-5-one Openeye Name: 7-methoxy-3-(methoxymethyl)-4-[4-[4-(2-methoxyphenyl)piperazin-1-yl]butyl]-1,4-benzoxazepin-5-one CAS Name: 7-methoxy-3-(methoxymethyl)-4-[4-[4-(2-methoxyphenyl)-1-piperazinyl]butyl]-1,4-benzoxazepin-5-one IUPAC Name: 7-methoxy-3-(methoxymethyl)-4-[4-[4-(2-methoxyphenyl)piperazin-1-yl]butyl]-1,4-benzoxazepin-5-one Traditional Name: 7-methoxy-3-(methoxymethyl)-4-[4-[4-(2-methoxyphenyl)piperazino]butyl]-1,4-benzoxazepin-5-one Formula: C27H35N3O5 MolecularWeight: 481.5839

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Descriptors Computed from Structure

Canonical SMILES:

COCC1=COC2=C(C=C(C=C2)OC)C(=O)N1CCCCN3CCN(CC3)C4=CC=CC=C4OC

Isomeric SMILES

COCC1=COC2=C(C=C(C=C2)OC)C(=O)N1CCCCN3CCN(CC3)C4=CC=CC=C4OC

InChI

InChI=1S/C27H35N3O5/c1-32-19-21-20-35-25-11-10-22(33-2)18-23(25)27(31)30(21)13-7-6-12-28-14-16-29(17-15-28)24-8-4-5-9-26(24)34-3/h4-5,8-11,18,20H,6-7,12-17,19H2,1-3H3