N-[(2S)-2-(4-ethoxy-3-methoxy-phenyl)-2-morpholin-4-ium-4-yl-ethyl]-4-ethyl-benzamide

Systemtic Name: N-[(2S)-2-(4-ethoxy-3-methoxy-phenyl)-2-morpholin-4-ium-4-yl-ethyl]-4-ethyl-benzamide Openeye Name: N-[(2S)-2-(4-ethoxy-3-methoxy-phenyl)-2-morpholin-4-ium-4-yl-ethyl]-4-ethyl-benzamide CAS Name: N-[(2S)-2-(4-ethoxy-3-methoxyphenyl)-2-(4-morpholin-4-iumyl)ethyl]-4-ethylbenzamide IUPAC Name: N-[(2S)-2-(4-ethoxy-3-methoxyphenyl)-2-morpholin-4-ium-4-ylethyl]-4-ethylbenzamide Traditional Name: N-[(2S)-2-(4-ethoxy-3-methoxy-phenyl)-2-morpholin-4-ium-4-yl-ethyl]-4-ethyl-benzamide Formula: C24H33N2O4+ MolecularWeight: 413.52982

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C(=O)NCC(C2=CC(=C(C=C2)OCC)OC)[NH+]3CCOCC3

Isomeric SMILES

CCC1=CC=C(C=C1)C(=O)NC[C@H](C2=CC(=C(C=C2)OCC)OC)[NH+]3CCOCC3

InChI

InChI=1S/C24H32N2O4/c1-4-18-6-8-19(9-7-18)24(27)25-17-21(26-12-14-29-15-13-26)20-10-11-22(30-5-2)23(16-20)28-3/h6-11,16,21H,4-5,12-15,17H2,1-3H3,(H,25,27)/p+1/t21-/m1/s1