7-[3-[4-[(4-chlorophenyl)methyl]piperazin-1-yl]-2-oxidanyl-propoxy]-4-phenylmethoxy-8-prop-2-enyl-chromen-2-one

Systemtic Name: 7-[3-[4-[(4-chlorophenyl)methyl]piperazin-1-yl]-2-oxidanyl-propoxy]-4-phenylmethoxy-8-prop-2-enyl-chromen-2-one Openeye Name: 8-allyl-4-benzyloxy-7-[3-[4-[(4-chlorophenyl)methyl]piperazin-1-yl]-2-hydroxy-propoxy]chromen-2-one CAS Name: 7-[3-[4-[(4-chlorophenyl)methyl]-1-piperazinyl]-2-hydroxypropoxy]-4-phenylmethoxy-8-prop-2-enyl-1-benzopyran-2-one IUPAC Name: 7-[3-[4-[(4-chlorophenyl)methyl]piperazin-1-yl]-2-hydroxypropoxy]-4-phenylmethoxy-8-prop-2-enylchromen-2-one Traditional Name: 8-allyl-4-benzoxy-7-[3-[4-(4-chlorobenzyl)piperazino]-2-hydroxy-propoxy]coumarin Formula: C33H35ClN2O5 MolecularWeight: 575.0944

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Descriptors Computed from Structure

Canonical SMILES:

C=CCC1=C(C=CC2=C1OC(=O)C=C2OCC3=CC=CC=C3)OCC(CN4CCN(CC4)CC5=CC=C(C=C5)Cl)O

Isomeric SMILES

C=CCC1=C(C=CC2=C1OC(=O)C=C2OCC3=CC=CC=C3)OCC(CN4CCN(CC4)CC5=CC=C(C=C5)Cl)O

InChI

InChI=1S/C33H35ClN2O5/c1-2-6-28-30(14-13-29-31(19-32(38)41-33(28)29)39-22-25-7-4-3-5-8-25)40-23-27(37)21-36-17-15-35(16-18-36)20-24-9-11-26(34)12-10-24/h2-5,7-14,19,27,37H,1,6,15-18,20-23H2