N-butyl-2-methyl-prop-2-enamide; N-propan-2-ylprop-2-enamide; prop-2-enoic acid

Systemtic Name: N-butyl-2-methyl-prop-2-enamide; N-propan-2-ylprop-2-enamide; prop-2-enoic acid Openeye Name: acrylic acid; N-butyl-2-methyl-prop-2-enamide; N-isopropylprop-2-enamide CAS Name: N-butyl-2-methyl-2-propenamide; N-propan-2-yl-2-propenamide; 2-propenoic acid IUPAC Name: N-butyl-2-methylprop-2-enamide; N-propan-2-ylprop-2-enamide; prop-2-enoic acid Traditional Name: acrylic acid; N-butyl-2-methyl-acrylamide; N-isopropylacrylamide Formula: C17H30N2O4 MolecularWeight: 326.4311

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=O)C(=C)C.CC(C)NC(=O)C=C.C=CC(=O)O

Isomeric SMILES

CCCCNC(=O)C(=C)C.CC(C)NC(=O)C=C.C=CC(=O)O

InChI

InChI=1S/C8H15NO.C6H11NO.C3H4O2/c1-4-5-6-9-8(10)7(2)3;1-4-6(8)7-5(2)3;1-2-3(4)5/h2,4-6H2,1,3H3,(H,9,10);4-5H,1H2,2-3H3,(H,7,8);2H,1H2,(H,4,5)