2-butyl-7-[ethyl(methyl)azaniumyl]-2-(6-methoxynaphthalen-2-yl)heptanoate

Systemtic Name: 2-butyl-7-[ethyl(methyl)azaniumyl]-2-(6-methoxynaphthalen-2-yl)heptanoate Openeye Name: 2-butyl-7-[ethyl(methyl)ammonio]-2-(6-methoxy-2-naphthyl)heptanoate CAS Name: 2-butyl-7-[ethyl(methyl)ammonio]-2-(6-methoxy-2-naphthalenyl)heptanoate IUPAC Name: 2-butyl-7-[ethyl(methyl)azaniumyl]-2-(6-methoxynaphthalen-2-yl)heptanoate Traditional Name: 2-butyl-7-[ethyl(methyl)ammonio]-2-(6-methoxy-2-naphthyl)enanthate Formula: C25H37NO3 MolecularWeight: 399.56618

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CCCCC[NH+](C)CC)(C1=CC2=C(C=C1)C=C(C=C2)OC)C(=O)[O-]

Isomeric SMILES

CCCCC(CCCCC[NH+](C)CC)(C1=CC2=C(C=C1)C=C(C=C2)OC)C(=O)[O-]

InChI

InChI=1S/C25H37NO3/c1-5-7-15-25(24(27)28,16-9-8-10-17-26(3)6-2)22-13-11-21-19-23(29-4)14-12-20(21)18-22/h11-14,18-19H,5-10,15-17H2,1-4H3,(H,27,28)