N-[4-[4-(2-methoxyphenyl)piperazin-1-yl]butyl]-2-oxidanylidene-chromene-3-carboxamide dihydrochloride

Systemtic Name: N-[4-[4-(2-methoxyphenyl)piperazin-1-yl]butyl]-2-oxidanylidene-chromene-3-carboxamide dihydrochloride Openeye Name: N-[4-[4-(2-methoxyphenyl)piperazin-1-yl]butyl]-2-oxo-chromene-3-carboxamide dihydrochloride CAS Name: N-[4-[4-(2-methoxyphenyl)-1-piperazinyl]butyl]-2-oxo-1-benzopyran-3-carboxamide dihydrochloride IUPAC Name: N-[4-[4-(2-methoxyphenyl)piperazin-1-yl]butyl]-2-oxochromene-3-carboxamide dihydrochloride Traditional Name: 2-keto-N-[4-[4-(2-methoxyphenyl)piperazino]butyl]chromene-3-carboxamide dihydrochloride Formula: C25H31Cl2N3O4 MolecularWeight: 508.43734

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1N2CCN(CC2)CCCCNC(=O)C3=CC4=CC=CC=C4OC3=O.Cl.Cl

Isomeric SMILES

COC1=CC=CC=C1N2CCN(CC2)CCCCNC(=O)C3=CC4=CC=CC=C4OC3=O.Cl.Cl

InChI

InChI=1S/C25H29N3O4.2ClH/c1-31-23-11-5-3-9-21(23)28-16-14-27(15-17-28)13-7-6-12-26-24(29)20-18-19-8-2-4-10-22(19)32-25(20)30;;/h2-5,8-11,18H,6-7,12-17H2,1H3,(H,26,29);2*1H