3-[4-[4-[2-(4-methoxyphenyl)ethyl]piperidin-1-yl]-4-oxidanylidene-butyl]-6-nitro-1,3-benzoxazol-2-one

Systemtic Name: 3-[4-[4-[2-(4-methoxyphenyl)ethyl]piperidin-1-yl]-4-oxidanylidene-butyl]-6-nitro-1,3-benzoxazol-2-one Openeye Name: 3-[4-[4-[2-(4-methoxyphenyl)ethyl]-1-piperidyl]-4-oxo-butyl]-6-nitro-1,3-benzoxazol-2-one CAS Name: 3-[4-[4-[2-(4-methoxyphenyl)ethyl]-1-piperidinyl]-4-oxobutyl]-6-nitro-1,3-benzoxazol-2-one IUPAC Name: 3-[4-[4-[2-(4-methoxyphenyl)ethyl]piperidin-1-yl]-4-oxobutyl]-6-nitro-1,3-benzoxazol-2-one Traditional Name: 3-[4-keto-4-[4-[2-(4-methoxyphenyl)ethyl]piperidino]butyl]-6-nitro-1,3-benzoxazol-2-one Formula: C25H29N3O6 MolecularWeight: 467.51426

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CCC2CCN(CC2)C(=O)CCCN3C4=C(C=C(C=C4)[N+](=O)[O-])OC3=O

Isomeric SMILES

COC1=CC=C(C=C1)CCC2CCN(CC2)C(=O)CCCN3C4=C(C=C(C=C4)[N+](=O)[O-])OC3=O

InChI

InChI=1S/C25H29N3O6/c1-33-21-9-6-18(7-10-21)4-5-19-12-15-26(16-13-19)24(29)3-2-14-27-22-11-8-20(28(31)32)17-23(22)34-25(27)30/h6-11,17,19H,2-5,12-16H2,1H3