4-methyl-N-(3-methylbutan-2-yl)-3-nitro-N-[[1-(phenylmethyl)pyrrol-2-yl]methyl]benzamide

Systemtic Name: 4-methyl-N-(3-methylbutan-2-yl)-3-nitro-N-[[1-(phenylmethyl)pyrrol-2-yl]methyl]benzamide Openeye Name: N-[(1-benzylpyrrol-2-yl)methyl]-N-(1,2-dimethylpropyl)-4-methyl-3-nitro-benzamide CAS Name: 4-methyl-N-(3-methylbutan-2-yl)-3-nitro-N-[[1-(phenylmethyl)-2-pyrrolyl]methyl]benzamide IUPAC Name: N-[(1-benzylpyrrol-2-yl)methyl]-4-methyl-N-(3-methylbutan-2-yl)-3-nitrobenzamide Traditional Name: N-[(1-benzylpyrrol-2-yl)methyl]-N-(1,2-dimethylpropyl)-4-methyl-3-nitro-benzamide Formula: C25H29N3O3 MolecularWeight: 419.51606

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)N(CC2=CC=CN2CC3=CC=CC=C3)C(C)C(C)C)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)N(CC2=CC=CN2CC3=CC=CC=C3)C(C)C(C)C)[N+](=O)[O-]

InChI

InChI=1S/C25H29N3O3/c1-18(2)20(4)27(25(29)22-13-12-19(3)24(15-22)28(30)31)17-23-11-8-14-26(23)16-21-9-6-5-7-10-21/h5-15,18,20H,16-17H2,1-4H3