butanedioate; 1-[[5-[[4-(2-methoxyphenyl)piperazin-1-yl]methyl]furan-2-yl]methyl]azocan-2-one

Systemtic Name: butanedioate; 1-[[5-[[4-(2-methoxyphenyl)piperazin-1-yl]methyl]furan-2-yl]methyl]azocan-2-one Openeye Name: butanedioate; 1-[[5-[[4-(2-methoxyphenyl)piperazin-1-yl]methyl]-2-furyl]methyl]azocan-2-one CAS Name: butanedioate; 1-[[5-[[4-(2-methoxyphenyl)-1-piperazinyl]methyl]-2-furanyl]methyl]-2-azocanone IUPAC Name: butanedioate; 1-[[5-[[4-(2-methoxyphenyl)piperazin-1-yl]methyl]furan-2-yl]methyl]azocan-2-one Traditional Name: 1-[[5-[[4-(2-methoxyphenyl)piperazino]methyl]-2-furyl]methyl]azocan-2-one; succinate Formula: C28H37N3O7-2 MolecularWeight: 527.60928

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1N2CCN(CC2)CC3=CC=C(O3)CN4CCCCCCC4=O.C(CC(=O)[O-])C(=O)[O-]

Isomeric SMILES

COC1=CC=CC=C1N2CCN(CC2)CC3=CC=C(O3)CN4CCCCCCC4=O.C(CC(=O)[O-])C(=O)[O-]

InChI

InChI=1S/C24H33N3O3.C4H6O4/c1-29-23-9-6-5-8-22(23)26-16-14-25(15-17-26)18-20-11-12-21(30-20)19-27-13-7-3-2-4-10-24(27)28;5-3(6)1-2-4(7)8/h5-6,8-9,11-12H,2-4,7,10,13-19H2,1H3;1-2H2,(H,5,6)(H,7,8)/p-2