N-(furan-2-ylmethyl)-N-[(1-methylpyrrol-2-yl)methyl]-2-[(4-nitrophenyl)carbamoyl-prop-2-enyl-amino]ethanamide

Systemtic Name: N-(furan-2-ylmethyl)-N-[(1-methylpyrrol-2-yl)methyl]-2-[(4-nitrophenyl)carbamoyl-prop-2-enyl-amino]ethanamide Openeye Name: 2-[allyl-[(4-nitrophenyl)carbamoyl]amino]-N-(2-furylmethyl)-N-[(1-methylpyrrol-2-yl)methyl]acetamide CAS Name: N-(2-furanylmethyl)-N-[(1-methyl-2-pyrrolyl)methyl]-2-[[(4-nitroanilino)-oxomethyl]-prop-2-enylamino]acetamide IUPAC Name: N-(furan-2-ylmethyl)-N-[(1-methylpyrrol-2-yl)methyl]-2-[(4-nitrophenyl)carbamoyl-prop-2-enylamino]acetamide Traditional Name: 2-[allyl-[(4-nitrophenyl)carbamoyl]amino]-N-(2-furfuryl)-N-[(1-methylpyrrol-2-yl)methyl]acetamide Formula: C23H25N5O5 MolecularWeight: 451.4751

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=CC=C1CN(CC2=CC=CO2)C(=O)CN(CC=C)C(=O)NC3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CN1C=CC=C1CN(CC2=CC=CO2)C(=O)CN(CC=C)C(=O)NC3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C23H25N5O5/c1-3-12-26(23(30)24-18-8-10-19(11-9-18)28(31)32)17-22(29)27(16-21-7-5-14-33-21)15-20-6-4-13-25(20)2/h3-11,13-14H,1,12,15-17H2,2H3,(H,24,30)