3-[4-[(3,5-dimethylphenyl)carbamoyl]phenoxy]propylazanium

Systemtic Name: 3-[4-[(3,5-dimethylphenyl)carbamoyl]phenoxy]propylazanium Openeye Name: 3-[4-[(3,5-dimethylphenyl)carbamoyl]phenoxy]propylammonium CAS Name: 3-[4-[(3,5-dimethylanilino)-oxomethyl]phenoxy]propylammonium IUPAC Name: 3-[4-[(3,5-dimethylphenyl)carbamoyl]phenoxy]propylazanium Traditional Name: 3-[4-[(3,5-dimethylphenyl)carbamoyl]phenoxy]propylammonium Formula: C18H23N2O2+ MolecularWeight: 299.38742

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)NC(=O)C2=CC=C(C=C2)OCCC[NH3+])C

Isomeric SMILES

CC1=CC(=CC(=C1)NC(=O)C2=CC=C(C=C2)OCCC[NH3+])C

InChI

InChI=1S/C18H22N2O2/c1-13-10-14(2)12-16(11-13)20-18(21)15-4-6-17(7-5-15)22-9-3-8-19/h4-7,10-12H,3,8-9,19H2,1-2H3,(H,20,21)/p+1