(E)-N-[(2S)-2-morpholin-4-ium-4-yl-2-thiophen-2-yl-ethyl]-3-(2-nitrophenyl)prop-2-enamide

Systemtic Name: (E)-N-[(2S)-2-morpholin-4-ium-4-yl-2-thiophen-2-yl-ethyl]-3-(2-nitrophenyl)prop-2-enamide Openeye Name: (E)-N-[(2S)-2-morpholin-4-ium-4-yl-2-(2-thienyl)ethyl]-3-(2-nitrophenyl)prop-2-enamide CAS Name: (E)-N-[(2S)-2-(4-morpholin-4-iumyl)-2-thiophen-2-ylethyl]-3-(2-nitrophenyl)-2-propenamide IUPAC Name: (E)-N-[(2S)-2-morpholin-4-ium-4-yl-2-thiophen-2-ylethyl]-3-(2-nitrophenyl)prop-2-enamide Traditional Name: (E)-N-[(2S)-2-morpholin-4-ium-4-yl-2-(2-thienyl)ethyl]-3-(2-nitrophenyl)acrylamide Formula: C19H22N3O4S+ MolecularWeight: 388.46068

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Descriptors Computed from Structure

Canonical SMILES:

C1COCC[NH+]1C(CNC(=O)C=CC2=CC=CC=C2[N+](=O)[O-])C3=CC=CS3

Isomeric SMILES

C1COCC[NH+]1[C@@H](CNC(=O)/C=C/C2=CC=CC=C2[N+](=O)[O-])C3=CC=CS3

InChI

InChI=1S/C19H21N3O4S/c23-19(8-7-15-4-1-2-5-16(15)22(24)25)20-14-17(18-6-3-13-27-18)21-9-11-26-12-10-21/h1-8,13,17H,9-12,14H2,(H,20,23)/p+1/b8-7+/t17-/m0/s1