N-[(2S)-butan-2-yl]-4-(morpholin-4-ium-4-ylmethyl)benzamide

Systemtic Name: N-[(2S)-butan-2-yl]-4-(morpholin-4-ium-4-ylmethyl)benzamide Openeye Name: N-[(1S)-1-methylpropyl]-4-(morpholin-4-ium-4-ylmethyl)benzamide CAS Name: N-[(2S)-butan-2-yl]-4-(4-morpholin-4-iumylmethyl)benzamide IUPAC Name: N-[(2S)-butan-2-yl]-4-(morpholin-4-ium-4-ylmethyl)benzamide Traditional Name: N-[(1S)-1-methylpropyl]-4-(morpholin-4-ium-4-ylmethyl)benzamide Formula: C16H25N2O2+ MolecularWeight: 277.3819

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)NC(=O)C1=CC=C(C=C1)C[NH+]2CCOCC2

Isomeric SMILES

CC[C@H](C)NC(=O)C1=CC=C(C=C1)C[NH+]2CCOCC2

InChI

InChI=1S/C16H24N2O2/c1-3-13(2)17-16(19)15-6-4-14(5-7-15)12-18-8-10-20-11-9-18/h4-7,13H,3,8-12H2,1-2H3,(H,17,19)/p+1/t13-/m0/s1