3-[(4-methoxyphenyl)-(3-methylphenyl)carbonyl-amino]propylazanium

Systemtic Name: 3-[(4-methoxyphenyl)-(3-methylphenyl)carbonyl-amino]propylazanium Openeye Name: 3-(4-methoxy-N-(3-methylbenzoyl)anilino)propylammonium CAS Name: 3-(4-methoxy-N-[(3-methylphenyl)-oxomethyl]anilino)propylammonium IUPAC Name: 3-(4-methoxy-N-(3-methylbenzoyl)anilino)propylazanium Traditional Name: 3-(4-methoxy-N-m-toluoyl-anilino)propylammonium Formula: C18H23N2O2+ MolecularWeight: 299.38742

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C(=O)N(CCC[NH3+])C2=CC=C(C=C2)OC

Isomeric SMILES

CC1=CC=CC(=C1)C(=O)N(CCC[NH3+])C2=CC=C(C=C2)OC

InChI

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