[3-(3-phenylmethoxypropanoylamino)phenyl]methylazanium

Systemtic Name: [3-(3-phenylmethoxypropanoylamino)phenyl]methylazanium Openeye Name: [3-(3-benzyloxypropanoylamino)phenyl]methylammonium CAS Name: [3-[(1-oxo-3-phenylmethoxypropyl)amino]phenyl]methylammonium IUPAC Name: [3-(3-phenylmethoxypropanoylamino)phenyl]methylazanium Traditional Name: [3-(3-benzoxypropanoylamino)benzyl]ammonium Formula: C17H21N2O2+ MolecularWeight: 285.36084

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COCCC(=O)NC2=CC=CC(=C2)C[NH3+]

Isomeric SMILES

C1=CC=C(C=C1)COCCC(=O)NC2=CC=CC(=C2)C[NH3+]

InChI

InChI=1S/C17H20N2O2/c18-12-15-7-4-8-16(11-15)19-17(20)9-10-21-13-14-5-2-1-3-6-14/h1-8,11H,9-10,12-13,18H2,(H,19,20)/p+1