4-[4-[4-(3-methoxyphenyl)piperazin-1-yl]butyl]-1,4-benzoxazepine-3,5-dione

Systemtic Name: 4-[4-[4-(3-methoxyphenyl)piperazin-1-yl]butyl]-1,4-benzoxazepine-3,5-dione Openeye Name: 4-[4-[4-(3-methoxyphenyl)piperazin-1-yl]butyl]-1,4-benzoxazepine-3,5-dione CAS Name: 4-[4-[4-(3-methoxyphenyl)-1-piperazinyl]butyl]-1,4-benzoxazepine-3,5-dione IUPAC Name: 4-[4-[4-(3-methoxyphenyl)piperazin-1-yl]butyl]-1,4-benzoxazepine-3,5-dione Traditional Name: 4-[4-[4-(3-methoxyphenyl)piperazino]butyl]-1,4-benzoxazepine-3,5-quinone Formula: C24H29N3O4 MolecularWeight: 423.50476

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)N2CCN(CC2)CCCCN3C(=O)COC4=CC=CC=C4C3=O

Isomeric SMILES

COC1=CC=CC(=C1)N2CCN(CC2)CCCCN3C(=O)COC4=CC=CC=C4C3=O

InChI

InChI=1S/C24H29N3O4/c1-30-20-8-6-7-19(17-20)26-15-13-25(14-16-26)11-4-5-12-27-23(28)18-31-22-10-3-2-9-21(22)24(27)29/h2-3,6-10,17H,4-5,11-16,18H2,1H3