N-cyclopropyl-N-[2-[2-methylpropyl-[(1-methylpyrrol-2-yl)methyl]amino]-2-oxidanylidene-ethyl]-3-nitro-benzamide

Systemtic Name: N-cyclopropyl-N-[2-[2-methylpropyl-[(1-methylpyrrol-2-yl)methyl]amino]-2-oxidanylidene-ethyl]-3-nitro-benzamide Openeye Name: N-cyclopropyl-N-[2-[isobutyl-[(1-methylpyrrol-2-yl)methyl]amino]-2-oxo-ethyl]-3-nitro-benzamide CAS Name: N-cyclopropyl-N-[2-[2-methylpropyl-[(1-methyl-2-pyrrolyl)methyl]amino]-2-oxoethyl]-3-nitrobenzamide IUPAC Name: N-cyclopropyl-N-[2-[2-methylpropyl-[(1-methylpyrrol-2-yl)methyl]amino]-2-oxoethyl]-3-nitrobenzamide Traditional Name: N-cyclopropyl-N-[2-[isobutyl-[(1-methylpyrrol-2-yl)methyl]amino]-2-keto-ethyl]-3-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(C2CC2)C(=O)C3=CC(=CC=C3)[N+](=O)[O-]

Isomeric SMILES

CC(C)CN(CC1=CC=CN1C)C(=O)CN(C2CC2)C(=O)C3=CC(=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C22H28N4O4/c1-16(2)13-24(14-20-8-5-11-23(20)3)21(27)15-25(18-9-10-18)22(28)17-6-4-7-19(12-17)26(29)30/h4-8,11-12,16,18H,9-10,13-15H2,1-3H3