(E)-3-[2,5-bis(azanyl)phenyl]-N-(1-oxidanylbutan-2-yl)prop-2-enamide hydrochloride

Systemtic Name: (E)-3-[2,5-bis(azanyl)phenyl]-N-(1-oxidanylbutan-2-yl)prop-2-enamide hydrochloride Openeye Name: (E)-3-(2,5-diaminophenyl)-N-[1-(hydroxymethyl)propyl]prop-2-enamide hydrochloride CAS Name: (E)-3-(2,5-diaminophenyl)-N-(1-hydroxybutan-2-yl)-2-propenamide hydrochloride IUPAC Name: (E)-3-(2,5-diaminophenyl)-N-(1-hydroxybutan-2-yl)prop-2-enamide hydrochloride Traditional Name: (E)-3-(2,5-diaminophenyl)-N-(1-methylolpropyl)acrylamide hydrochloride Formula: C13H20ClN3O2 MolecularWeight: 285.7698

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CO)NC(=O)C=CC1=C(C=CC(=C1)N)N.Cl

Isomeric SMILES

CCC(CO)NC(=O)/C=C/C1=C(C=CC(=C1)N)N.Cl

InChI

InChI=1S/C13H19N3O2.ClH/c1-2-11(8-17)16-13(18)6-3-9-7-10(14)4-5-12(9)15;/h3-7,11,17H,2,8,14-15H2,1H3,(H,16,18);1H/b6-3+;