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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H22N2O2/c1-13-7-8-16(11-14(13)2)20-18(21)15-5-3-6-17(12-15)22-10-4-9-19/h3,5-8,11-12H,4,9-10,19H2,1-2H3,(H,20,21)/p+1