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

Systemtic Name: N-(2-methoxyethyl)-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-methoxyethyl)-N-[(1-methylpyrrol-2-yl)methyl]acetamide CAS Name: N-(2-methoxyethyl)-N-[(1-methyl-2-pyrrolyl)methyl]-2-[[(4-nitroanilino)-oxomethyl]-prop-2-enylamino]acetamide IUPAC Name: N-(2-methoxyethyl)-N-[(1-methylpyrrol-2-yl)methyl]-2-[(4-nitrophenyl)carbamoyl-prop-2-enylamino]acetamide Traditional Name: 2-[allyl-[(4-nitrophenyl)carbamoyl]amino]-N-(2-methoxyethyl)-N-[(1-methylpyrrol-2-yl)methyl]acetamide Formula: C21H27N5O5 MolecularWeight: 429.46958

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=CC=C1CN(CCOC)C(=O)CN(CC=C)C(=O)NC2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

CN1C=CC=C1CN(CCOC)C(=O)CN(CC=C)C(=O)NC2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C21H27N5O5/c1-4-11-25(21(28)22-17-7-9-18(10-8-17)26(29)30)16-20(27)24(13-14-31-3)15-19-6-5-12-23(19)2/h4-10,12H,1,11,13-16H2,2-3H3,(H,22,28)