N-[2-[1,3-benzodioxol-5-ylmethyl-[(6-chloranyl-4-oxidanylidene-chromen-3-yl)methyl]amino]-2-oxidanylidene-ethyl]-N-butyl-propanamide

Systemtic Name: N-[2-[1,3-benzodioxol-5-ylmethyl-[(6-chloranyl-4-oxidanylidene-chromen-3-yl)methyl]amino]-2-oxidanylidene-ethyl]-N-butyl-propanamide Openeye Name: N-[2-[1,3-benzodioxol-5-ylmethyl-[(6-chloro-4-oxo-chromen-3-yl)methyl]amino]-2-oxo-ethyl]-N-butyl-propanamide CAS Name: N-[2-[1,3-benzodioxol-5-ylmethyl-[(6-chloro-4-oxo-1-benzopyran-3-yl)methyl]amino]-2-oxoethyl]-N-butylpropanamide IUPAC Name: N-[2-[1,3-benzodioxol-5-ylmethyl-[(6-chloro-4-oxochromen-3-yl)methyl]amino]-2-oxoethyl]-N-butylpropanamide Traditional Name: N-butyl-N-[2-[(6-chloro-4-keto-chromen-3-yl)methyl-piperonyl-amino]-2-keto-ethyl]propionamide Formula: C27H29ClN2O6 MolecularWeight: 512.98196

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(CC(=O)N(CC1=CC2=C(C=C1)OCO2)CC3=COC4=C(C3=O)C=C(C=C4)Cl)C(=O)CC

Isomeric SMILES

CCCCN(CC(=O)N(CC1=CC2=C(C=C1)OCO2)CC3=COC4=C(C3=O)C=C(C=C4)Cl)C(=O)CC

InChI

InChI=1S/C27H29ClN2O6/c1-3-5-10-29(25(31)4-2)15-26(32)30(13-18-6-8-23-24(11-18)36-17-35-23)14-19-16-34-22-9-7-20(28)12-21(22)27(19)33/h6-9,11-12,16H,3-5,10,13-15,17H2,1-2H3