4-[(E)-3-[4-methoxy-3-(morpholin-4-ium-4-ylmethyl)phenyl]-3-oxidanylidene-prop-1-enyl]benzenecarbonitrile

Systemtic Name: 4-[(E)-3-[4-methoxy-3-(morpholin-4-ium-4-ylmethyl)phenyl]-3-oxidanylidene-prop-1-enyl]benzenecarbonitrile Openeye Name: 4-[(E)-3-[4-methoxy-3-(morpholin-4-ium-4-ylmethyl)phenyl]-3-oxo-prop-1-enyl]benzonitrile CAS Name: 4-[(E)-3-[4-methoxy-3-(4-morpholin-4-iumylmethyl)phenyl]-3-oxoprop-1-enyl]benzonitrile IUPAC Name: 4-[(E)-3-[4-methoxy-3-(morpholin-4-ium-4-ylmethyl)phenyl]-3-oxoprop-1-enyl]benzonitrile Traditional Name: 4-[(E)-3-keto-3-[4-methoxy-3-(morpholin-4-ium-4-ylmethyl)phenyl]prop-1-enyl]benzonitrile Formula: C22H23N2O3+ MolecularWeight: 363.42962

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(=O)C=CC2=CC=C(C=C2)C#N)C[NH+]3CCOCC3

Isomeric SMILES

COC1=C(C=C(C=C1)C(=O)/C=C/C2=CC=C(C=C2)C#N)C[NH+]3CCOCC3

InChI

InChI=1S/C22H22N2O3/c1-26-22-9-7-19(14-20(22)16-24-10-12-27-13-11-24)21(25)8-6-17-2-4-18(15-23)5-3-17/h2-9,14H,10-13,16H2,1H3/p+1/b8-6+