4-chloranyl-N-[[1-[(3-fluorophenyl)methyl]pyrrol-2-yl]methyl]-3-nitro-N-prop-2-enyl-benzamide

Systemtic Name: 4-chloranyl-N-[[1-[(3-fluorophenyl)methyl]pyrrol-2-yl]methyl]-3-nitro-N-prop-2-enyl-benzamide Openeye Name: N-allyl-4-chloro-N-[[1-[(3-fluorophenyl)methyl]pyrrol-2-yl]methyl]-3-nitro-benzamide CAS Name: 4-chloro-N-[[1-[(3-fluorophenyl)methyl]-2-pyrrolyl]methyl]-3-nitro-N-prop-2-enylbenzamide IUPAC Name: 4-chloro-N-[[1-[(3-fluorophenyl)methyl]pyrrol-2-yl]methyl]-3-nitro-N-prop-2-enylbenzamide Traditional Name: N-allyl-4-chloro-N-[[1-(3-fluorobenzyl)pyrrol-2-yl]methyl]-3-nitro-benzamide Formula: C22H19ClFN3O3 MolecularWeight: 427.855963

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Descriptors Computed from Structure

Canonical SMILES:

C=CCN(CC1=CC=CN1CC2=CC(=CC=C2)F)C(=O)C3=CC(=C(C=C3)Cl)[N+](=O)[O-]

Isomeric SMILES

C=CCN(CC1=CC=CN1CC2=CC(=CC=C2)F)C(=O)C3=CC(=C(C=C3)Cl)[N+](=O)[O-]

InChI

InChI=1S/C22H19ClFN3O3/c1-2-10-26(22(28)17-8-9-20(23)21(13-17)27(29)30)15-19-7-4-11-25(19)14-16-5-3-6-18(24)12-16/h2-9,11-13H,1,10,14-15H2