N-[2-[1,3-benzodioxol-5-ylmethyl-[(5-methylfuran-2-yl)methyl]amino]-2-oxidanylidene-ethyl]-3-nitro-N-propan-2-yl-benzamide

Systemtic Name: N-[2-[1,3-benzodioxol-5-ylmethyl-[(5-methylfuran-2-yl)methyl]amino]-2-oxidanylidene-ethyl]-3-nitro-N-propan-2-yl-benzamide Openeye Name: N-[2-[1,3-benzodioxol-5-ylmethyl-[(5-methyl-2-furyl)methyl]amino]-2-oxo-ethyl]-N-isopropyl-3-nitro-benzamide CAS Name: N-[2-[1,3-benzodioxol-5-ylmethyl-[(5-methyl-2-furanyl)methyl]amino]-2-oxoethyl]-3-nitro-N-propan-2-ylbenzamide IUPAC Name: N-[2-[1,3-benzodioxol-5-ylmethyl-[(5-methylfuran-2-yl)methyl]amino]-2-oxoethyl]-3-nitro-N-propan-2-ylbenzamide Traditional Name: N-isopropyl-N-[2-keto-2-[(5-methyl-2-furyl)methyl-piperonyl-amino]ethyl]-3-nitro-benzamide Formula: C26H27N3O7 MolecularWeight: 493.50848

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(O1)CN(CC2=CC3=C(C=C2)OCO3)C(=O)CN(C(C)C)C(=O)C4=CC(=CC=C4)[N+](=O)[O-]

Isomeric SMILES

CC1=CC=C(O1)CN(CC2=CC3=C(C=C2)OCO3)C(=O)CN(C(C)C)C(=O)C4=CC(=CC=C4)[N+](=O)[O-]

InChI

InChI=1S/C26H27N3O7/c1-17(2)28(26(31)20-5-4-6-21(12-20)29(32)33)15-25(30)27(14-22-9-7-18(3)36-22)13-19-8-10-23-24(11-19)35-16-34-23/h4-12,17H,13-16H2,1-3H3