1-[(1-methylpyrrol-2-yl)methyl]-1-(3-morpholin-4-ium-4-ylpropyl)-3-phenyl-urea

Systemtic Name: 1-[(1-methylpyrrol-2-yl)methyl]-1-(3-morpholin-4-ium-4-ylpropyl)-3-phenyl-urea Openeye Name: 1-[(1-methylpyrrol-2-yl)methyl]-1-(3-morpholin-4-ium-4-ylpropyl)-3-phenyl-urea CAS Name: 1-[(1-methyl-2-pyrrolyl)methyl]-1-[3-(4-morpholin-4-iumyl)propyl]-3-phenylurea IUPAC Name: 1-[(1-methylpyrrol-2-yl)methyl]-1-(3-morpholin-4-ium-4-ylpropyl)-3-phenylurea Traditional Name: 1-[(1-methylpyrrol-2-yl)methyl]-1-(3-morpholin-4-ium-4-ylpropyl)-3-phenyl-urea Formula: C20H29N4O2+ MolecularWeight: 357.46986

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=CC=C1CN(CCC[NH+]2CCOCC2)C(=O)NC3=CC=CC=C3

Isomeric SMILES

CN1C=CC=C1CN(CCC[NH+]2CCOCC2)C(=O)NC3=CC=CC=C3

InChI

InChI=1S/C20H28N4O2/c1-22-10-5-9-19(22)17-24(12-6-11-23-13-15-26-16-14-23)20(25)21-18-7-3-2-4-8-18/h2-5,7-10H,6,11-17H2,1H3,(H,21,25)/p+1