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

Systemtic Name: N-[2-[1,3-benzodioxol-5-ylmethyl-[(6-chloranyl-4-oxidanylidene-chromen-3-yl)methyl]amino]-2-oxidanylidene-ethyl]-4-tert-butyl-N-prop-2-enyl-benzamide Openeye Name: N-allyl-N-[2-[1,3-benzodioxol-5-ylmethyl-[(6-chloro-4-oxo-chromen-3-yl)methyl]amino]-2-oxo-ethyl]-4-tert-butyl-benzamide CAS Name: N-[2-[1,3-benzodioxol-5-ylmethyl-[(6-chloro-4-oxo-1-benzopyran-3-yl)methyl]amino]-2-oxoethyl]-4-tert-butyl-N-prop-2-enylbenzamide IUPAC Name: N-[2-[1,3-benzodioxol-5-ylmethyl-[(6-chloro-4-oxochromen-3-yl)methyl]amino]-2-oxoethyl]-4-tert-butyl-N-prop-2-enylbenzamide Traditional Name: N-allyl-4-tert-butyl-N-[2-[(6-chloro-4-keto-chromen-3-yl)methyl-piperonyl-amino]-2-keto-ethyl]benzamide Formula: C34H33ClN2O6 MolecularWeight: 601.08862

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)C(=O)N(CC=C)CC(=O)N(CC2=CC3=C(C=C2)OCO3)CC4=COC5=C(C4=O)C=C(C=C5)Cl

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)C(=O)N(CC=C)CC(=O)N(CC2=CC3=C(C=C2)OCO3)CC4=COC5=C(C4=O)C=C(C=C5)Cl

InChI

InChI=1S/C34H33ClN2O6/c1-5-14-36(33(40)23-7-9-25(10-8-23)34(2,3)4)19-31(38)37(17-22-6-12-29-30(15-22)43-21-42-29)18-24-20-41-28-13-11-26(35)16-27(28)32(24)39/h5-13,15-16,20H,1,14,17-19,21H2,2-4H3