N-[(Z)-1-[4-methoxy-3-(pyrrolidin-1-ium-1-ylmethyl)phenyl]ethylideneamino]benzamide

Systemtic Name: N-[(Z)-1-[4-methoxy-3-(pyrrolidin-1-ium-1-ylmethyl)phenyl]ethylideneamino]benzamide Openeye Name: N-[(Z)-1-[4-methoxy-3-(pyrrolidin-1-ium-1-ylmethyl)phenyl]ethylideneamino]benzamide CAS Name: N-[(Z)-1-[4-methoxy-3-(1-pyrrolidin-1-iumylmethyl)phenyl]ethylideneamino]benzamide IUPAC Name: N-[(Z)-1-[4-methoxy-3-(pyrrolidin-1-ium-1-ylmethyl)phenyl]ethylideneamino]benzamide Traditional Name: N-[(Z)-1-[4-methoxy-3-(pyrrolidin-1-ium-1-ylmethyl)phenyl]ethylideneamino]benzamide Formula: C21H26N3O2+ MolecularWeight: 352.45004

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Descriptors Computed from Structure

Canonical SMILES:

CC(=NNC(=O)C1=CC=CC=C1)C2=CC(=C(C=C2)OC)C[NH+]3CCCC3

Isomeric SMILES

C/C(=N/NC(=O)C1=CC=CC=C1)/C2=CC(=C(C=C2)OC)C[NH+]3CCCC3

InChI

InChI=1S/C21H25N3O2/c1-16(22-23-21(25)17-8-4-3-5-9-17)18-10-11-20(26-2)19(14-18)15-24-12-6-7-13-24/h3-5,8-11,14H,6-7,12-13,15H2,1-2H3,(H,23,25)/p+1/b22-16-