N-[4-(3-methylphenoxy)phenyl]-4-(morpholin-4-ium-4-ylmethyl)benzamide

Systemtic Name: N-[4-(3-methylphenoxy)phenyl]-4-(morpholin-4-ium-4-ylmethyl)benzamide Openeye Name: N-[4-(3-methylphenoxy)phenyl]-4-(morpholin-4-ium-4-ylmethyl)benzamide CAS Name: N-[4-(3-methylphenoxy)phenyl]-4-(4-morpholin-4-iumylmethyl)benzamide IUPAC Name: N-[4-(3-methylphenoxy)phenyl]-4-(morpholin-4-ium-4-ylmethyl)benzamide Traditional Name: N-[4-(3-methylphenoxy)phenyl]-4-(morpholin-4-ium-4-ylmethyl)benzamide Formula: C25H27N2O3+ MolecularWeight: 403.49348

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)OC2=CC=C(C=C2)NC(=O)C3=CC=C(C=C3)C[NH+]4CCOCC4

Isomeric SMILES

CC1=CC(=CC=C1)OC2=CC=C(C=C2)NC(=O)C3=CC=C(C=C3)C[NH+]4CCOCC4

InChI

InChI=1S/C25H26N2O3/c1-19-3-2-4-24(17-19)30-23-11-9-22(10-12-23)26-25(28)21-7-5-20(6-8-21)18-27-13-15-29-16-14-27/h2-12,17H,13-16,18H2,1H3,(H,26,28)/p+1