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

Systemtic Name: N-[[1-[(3-methoxyphenyl)methyl]pyrrol-2-yl]methyl]-4-methyl-3-nitro-N-prop-2-enyl-benzamide Openeye Name: N-allyl-N-[[1-[(3-methoxyphenyl)methyl]pyrrol-2-yl]methyl]-4-methyl-3-nitro-benzamide CAS Name: N-[[1-[(3-methoxyphenyl)methyl]-2-pyrrolyl]methyl]-4-methyl-3-nitro-N-prop-2-enylbenzamide IUPAC Name: N-[[1-[(3-methoxyphenyl)methyl]pyrrol-2-yl]methyl]-4-methyl-3-nitro-N-prop-2-enylbenzamide Traditional Name: N-allyl-N-[(1-m-anisylpyrrol-2-yl)methyl]-4-methyl-3-nitro-benzamide Formula: C24H25N3O4 MolecularWeight: 419.473

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C24H25N3O4/c1-4-12-26(24(28)20-11-10-18(2)23(15-20)27(29)30)17-21-8-6-13-25(21)16-19-7-5-9-22(14-19)31-3/h4-11,13-15H,1,12,16-17H2,2-3H3