2-(6-methoxynaphthalen-2-yl)propanoate; 1-methylpyridin-1-ium-3-carboxamide

Systemtic Name: 2-(6-methoxynaphthalen-2-yl)propanoate; 1-methylpyridin-1-ium-3-carboxamide Openeye Name: 2-(6-methoxy-2-naphthyl)propanoate; 1-methylpyridin-1-ium-3-carboxamide CAS Name: 2-(6-methoxy-2-naphthalenyl)propanoate; 1-methyl-3-pyridin-1-iumcarboxamide IUPAC Name: 2-(6-methoxynaphthalen-2-yl)propanoate; 1-methylpyridin-1-ium-3-carboxamide Traditional Name: 2-(6-methoxy-2-naphthyl)propionate; 1-methylpyridin-1-ium-3-carboxamide Formula: C21H22N2O4 MolecularWeight: 366.41038

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC2=C(C=C1)C=C(C=C2)OC)C(=O)[O-].C[N+]1=CC=CC(=C1)C(=O)N

Isomeric SMILES

CC(C1=CC2=C(C=C1)C=C(C=C2)OC)C(=O)[O-].C[N+]1=CC=CC(=C1)C(=O)N

InChI

InChI=1S/C14H14O3.C7H8N2O/c1-9(14(15)16)10-3-4-12-8-13(17-2)6-5-11(12)7-10;1-9-4-2-3-6(5-9)7(8)10/h3-9H,1-2H3,(H,15,16);2-5H,1H3,(H-,8,10)