3-(3,4-dichlorophenyl)-4-methoxy-4-oxidanylidene-butanoic acid; 1-naphthalen-1-ylethanamine

Systemtic Name: 3-(3,4-dichlorophenyl)-4-methoxy-4-oxidanylidene-butanoic acid; 1-naphthalen-1-ylethanamine Openeye Name: 3-(3,4-dichlorophenyl)-4-methoxy-4-oxo-butanoic acid; 1-(1-naphthyl)ethanamine CAS Name: 3-(3,4-dichlorophenyl)-4-methoxy-4-oxobutanoic acid; 1-(1-naphthalenyl)ethanamine IUPAC Name: 3-(3,4-dichlorophenyl)-4-methoxy-4-oxobutanoic acid; 1-naphthalen-1-ylethanamine Traditional Name: 3-(3,4-dichlorophenyl)-4-keto-4-methoxy-butyric acid; 1-(1-naphthyl)ethylamine Formula: C23H23Cl2NO4 MolecularWeight: 448.33902

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC2=CC=CC=C21)N.COC(=O)C(CC(=O)O)C1=CC(=C(C=C1)Cl)Cl

Isomeric SMILES

CC(C1=CC=CC2=CC=CC=C21)N.COC(=O)C(CC(=O)O)C1=CC(=C(C=C1)Cl)Cl

InChI

InChI=1S/C12H13N.C11H10Cl2O4/c1-9(13)11-8-4-6-10-5-2-3-7-12(10)11;1-17-11(16)7(5-10(14)15)6-2-3-8(12)9(13)4-6/h2-9H,13H2,1H3;2-4,7H,5H2,1H3,(H,14,15)