1-[[1-[(3-methylphenyl)methyl]pyrrol-2-yl]methyl]-3-(4-nitrophenyl)-1-prop-2-enyl-urea

Systemtic Name: 1-[[1-[(3-methylphenyl)methyl]pyrrol-2-yl]methyl]-3-(4-nitrophenyl)-1-prop-2-enyl-urea Openeye Name: 1-allyl-1-[[1-(m-tolylmethyl)pyrrol-2-yl]methyl]-3-(4-nitrophenyl)urea CAS Name: 1-[[1-[(3-methylphenyl)methyl]-2-pyrrolyl]methyl]-3-(4-nitrophenyl)-1-prop-2-enylurea IUPAC Name: 1-[[1-[(3-methylphenyl)methyl]pyrrol-2-yl]methyl]-3-(4-nitrophenyl)-1-prop-2-enylurea Traditional Name: 1-allyl-1-[[1-(3-methylbenzyl)pyrrol-2-yl]methyl]-3-(4-nitrophenyl)urea Formula: C23H24N4O3 MolecularWeight: 404.46166

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)CN2C=CC=C2CN(CC=C)C(=O)NC3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=CC=C1)CN2C=CC=C2CN(CC=C)C(=O)NC3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C23H24N4O3/c1-3-13-26(23(28)24-20-9-11-21(12-10-20)27(29)30)17-22-8-5-14-25(22)16-19-7-4-6-18(2)15-19/h3-12,14-15H,1,13,16-17H2,2H3,(H,24,28)