2-methoxy-4-[4-[2-(6-nitro-3,4-dihydro-2H-chromen-4-yl)ethyl]piperazin-1-yl]phenol

Systemtic Name: 2-methoxy-4-[4-[2-(6-nitro-3,4-dihydro-2H-chromen-4-yl)ethyl]piperazin-1-yl]phenol Openeye Name: 2-methoxy-4-[4-[2-(6-nitrochroman-4-yl)ethyl]piperazin-1-yl]phenol CAS Name: 2-methoxy-4-[4-[2-(6-nitro-3,4-dihydro-2H-1-benzopyran-4-yl)ethyl]-1-piperazinyl]phenol IUPAC Name: 2-methoxy-4-[4-[2-(6-nitro-3,4-dihydro-2H-chromen-4-yl)ethyl]piperazin-1-yl]phenol Traditional Name: 2-methoxy-4-[4-[2-(6-nitrochroman-4-yl)ethyl]piperazino]phenol Formula: C22H27N3O5 MolecularWeight: 413.46688

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)N2CCN(CC2)CCC3CCOC4=C3C=C(C=C4)[N+](=O)[O-])O

Isomeric SMILES

COC1=C(C=CC(=C1)N2CCN(CC2)CCC3CCOC4=C3C=C(C=C4)[N+](=O)[O-])O

InChI

InChI=1S/C22H27N3O5/c1-29-22-15-17(2-4-20(22)26)24-11-9-23(10-12-24)8-6-16-7-13-30-21-5-3-18(25(27)28)14-19(16)21/h2-5,14-16,26H,6-13H2,1H3