N-[2-[2-methylpropyl-[(1-methylpyrrol-2-yl)methyl]amino]-2-oxidanylidene-ethyl]-4-nitro-N-prop-2-enyl-benzamide

Systemtic Name: N-[2-[2-methylpropyl-[(1-methylpyrrol-2-yl)methyl]amino]-2-oxidanylidene-ethyl]-4-nitro-N-prop-2-enyl-benzamide Openeye Name: N-allyl-N-[2-[isobutyl-[(1-methylpyrrol-2-yl)methyl]amino]-2-oxo-ethyl]-4-nitro-benzamide CAS Name: N-[2-[2-methylpropyl-[(1-methyl-2-pyrrolyl)methyl]amino]-2-oxoethyl]-4-nitro-N-prop-2-enylbenzamide IUPAC Name: N-[2-[2-methylpropyl-[(1-methylpyrrol-2-yl)methyl]amino]-2-oxoethyl]-4-nitro-N-prop-2-enylbenzamide Traditional Name: N-allyl-N-[2-[isobutyl-[(1-methylpyrrol-2-yl)methyl]amino]-2-keto-ethyl]-4-nitro-benzamide Formula: C22H28N4O4 MolecularWeight: 412.48212

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN(CC1=CC=CN1C)C(=O)CN(CC=C)C(=O)C2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

CC(C)CN(CC1=CC=CN1C)C(=O)CN(CC=C)C(=O)C2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C22H28N4O4/c1-5-12-24(22(28)18-8-10-19(11-9-18)26(29)30)16-21(27)25(14-17(2)3)15-20-7-6-13-23(20)4/h5-11,13,17H,1,12,14-16H2,2-4H3