N-[2-[furan-2-ylmethyl(phenethyl)amino]-2-oxidanylidene-ethyl]-4-methyl-N-(2-methylpropyl)-3-nitro-benzamide

Systemtic Name: N-[2-[furan-2-ylmethyl(phenethyl)amino]-2-oxidanylidene-ethyl]-4-methyl-N-(2-methylpropyl)-3-nitro-benzamide Openeye Name: N-[2-[2-furylmethyl(phenethyl)amino]-2-oxo-ethyl]-N-isobutyl-4-methyl-3-nitro-benzamide CAS Name: N-[2-[2-furanylmethyl(phenethyl)amino]-2-oxoethyl]-4-methyl-N-(2-methylpropyl)-3-nitrobenzamide IUPAC Name: N-[2-[furan-2-ylmethyl(phenethyl)amino]-2-oxoethyl]-4-methyl-N-(2-methylpropyl)-3-nitrobenzamide Traditional Name: N-[2-[2-furfuryl(phenethyl)amino]-2-keto-ethyl]-N-isobutyl-4-methyl-3-nitro-benzamide Formula: C27H31N3O5 MolecularWeight: 477.55214

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)N(CC(C)C)CC(=O)N(CCC2=CC=CC=C2)CC3=CC=CO3)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)N(CC(C)C)CC(=O)N(CCC2=CC=CC=C2)CC3=CC=CO3)[N+](=O)[O-]

InChI

InChI=1S/C27H31N3O5/c1-20(2)17-29(27(32)23-12-11-21(3)25(16-23)30(33)34)19-26(31)28(18-24-10-7-15-35-24)14-13-22-8-5-4-6-9-22/h4-12,15-16,20H,13-14,17-19H2,1-3H3