2-[4-[(3-cyanophenyl)carbamoyl]phenoxy]ethylazanium

Systemtic Name: 2-[4-[(3-cyanophenyl)carbamoyl]phenoxy]ethylazanium Openeye Name: 2-[4-[(3-cyanophenyl)carbamoyl]phenoxy]ethylammonium CAS Name: 2-[4-[(3-cyanoanilino)-oxomethyl]phenoxy]ethylammonium IUPAC Name: 2-[4-[(3-cyanophenyl)carbamoyl]phenoxy]ethylazanium Traditional Name: 2-[4-[(3-cyanophenyl)carbamoyl]phenoxy]ethylammonium Formula: C16H16N3O2+ MolecularWeight: 282.31714

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)NC(=O)C2=CC=C(C=C2)OCC[NH3+])C#N

Isomeric SMILES

C1=CC(=CC(=C1)NC(=O)C2=CC=C(C=C2)OCC[NH3+])C#N

InChI

InChI=1S/C16H15N3O2/c17-8-9-21-15-6-4-13(5-7-15)16(20)19-14-3-1-2-12(10-14)11-18/h1-7,10H,8-9,17H2,(H,19,20)/p+1